4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile

C22H25N7O2 — CID 142447453

IUPAC4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile
SMILESCNC(=O)c1c(C)c(-c2cc3cc(NC=O)ncc3c(N)n2)c(C)n1C.N#CC1CC1
InChIInChI=1S/C18H20N6O2.C4H5N/c1-9-15(10(2)24(4)16(9)18(26)20-3)13-5-11-6-14(22-8-25)21-7-12(11)17(19)23-13;5-3-4-1-2-4/h5-8H,1-4H3,(H2,19,23)(H,20,26)(H,21,22,25);4H,1-2H2
InChIKeyMOJLXHDBSZFIQV-UHFFFAOYSA-N
MW419.49 g/mol
LogP2.68
Rot. Bonds4

About 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile

4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile (PubChem CID 142447453) has the molecular formula C22H25N7O2 and a molecular weight of 419.49 g/mol. Its IUPAC name is 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile.

Molecular Properties

Compound Name4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile
PubChem CID142447453
Molecular FormulaC22H25N7O2
Molecular Weight419.49 g/mol
Exact Mass419.21
IUPAC Name4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile
SMILESCNC(=O)c1c(C)c(-c2cc3cc(NC=O)ncc3c(N)n2)c(C)n1C.N#CC1CC1
InChIInChI=1S/C18H20N6O2.C4H5N/c1-9-15(10(2)24(4)16(9)18(26)20-3)13-5-11-6-14(22-8-25)21-7-12(11)17(19)23-13;5-3-4-1-2-4/h5-8H,1-4H3,(H2,19,23)(H,20,26)(H,21,22,25);4H,1-2H2
InChIKeyMOJLXHDBSZFIQV-UHFFFAOYSA-N
XLogP2.68
TPSA138.72 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.49
LogP ≤ 52.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[1-amino-6-[[(1S,2S)-2-cyanocyclopropanecarbonyl]amino]-2,7-naphthyridin-3-yl]-N,1,3,5-tetramethylpyrrole-2-carboxamide;4-[1-amino-6-[[(1R,2R)-2-cyanocyclopropanecarbonyl]amino]-2,7-naphthyridin-3-yl]-N,1,3,5-tetramethylpyrrole-2-carboxamide;2-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-N,2-dimethylpropanamide;trans-(1S,2S)-N-[8-amino-6-(3-amino-2,6-dimethylphenyl)-2,7-naphthyridin-3-yl]-2-methylcyclopropane-1-carboxamide;trans-(1R,2R)-N-[8-amino-6-(3-amino-2,6-dimethylphenyl)-2,7-naphthyridin-3-yl]-2-methylcyclopropane-1-carboxamide
CID 158810696
N-[8-amino-6-[2-(cyanomethyl)-6-methylphenyl]-2,7-naphthyridin-3-yl]formamide;4-cyclopropyl-1-methylpyrazole
CID 142447426
N-[8-amino-6-[4-methyl-5-(methylamino)-3-pyridinyl]-2,7-naphthyridin-3-yl]formamide;cyclopropane
CID 142447705
(E)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-4-(4-cyanopiperidin-1-yl)-4-oxobut-2-enamide
CID 155477816
N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]formamide;cyclopropane
CID 142447667
trans-(1S,2S)-N-[8-amino-6-(1,3,5-trimethylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-(trifluoromethyl)cyclopropane-1-carboxamide
CID 139468711
N-[8-amino-6-(1,3,5-trimethylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-(trifluoromethyl)cyclopropane-1-carboxamide
CID 135344881
N-[8-amino-6-(3-amino-2-methylphenyl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 142447326
1-[8-amino-6-(5-amino-4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-3-methylurea
CID 135344907
4-[1-amino-6-(cyclopropanecarbonylamino)-2,7-naphthyridin-3-yl]-3-fluoro-5-methylbenzamide
CID 142447727
N-[8-amino-6-(1,5-dimethylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-fluorocyclopropane-1-carboxamide
CID 135344388
cis-(1S,2R)-N-[8-amino-6-(2-fluoro-6-methylphenyl)-2,7-naphthyridin-3-yl]-2-(cyanomethyl)cyclopropane-1-carboxamide
CID 135345456

Frequently Asked Questions

What is the IUPAC name of 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile?
The IUPAC name of 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile (CID 142447453) is 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile.
What is the SMILES notation for 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile?
The canonical SMILES for 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile is CNC(=O)c1c(C)c(-c2cc3cc(NC=O)ncc3c(N)n2)c(C)n1C.N#CC1CC1.
What is the InChIKey of 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile?
The InChIKey is MOJLXHDBSZFIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2.C4H5N/c1-9-15(10(2)24(4)16(9)18(26)20-3)13-5-11-6-14(22-8-25)21-7-12(11)17(19)23-13;5-3-4-1-2-4/h5-8H,1-4H3,(H2,19,23)(H,20,26)(H,21,22,25);4H,1-2H2.
What are the key properties of 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile?
4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile has a molecular weight of 419.49 g/mol, XLogP of 2.68, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-amino-6-formamido-2,7-naphthyridin-3-yl)-N,1,3,5-tetramethylpyrrole-2-carboxamide;cyclopropanecarbonitrile is sourced from PubChem (CID 142447453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).