N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide

C15H19N7O — CID 91782573

IUPACN-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
SMILESCc1ccc2c(c1)c(CNC(=O)CCn1nnnc1C)nn2C
InChIInChI=1S/C15H19N7O/c1-10-4-5-14-12(8-10)13(18-21(14)3)9-16-15(23)6-7-22-11(2)17-19-20-22/h4-5,8H,6-7,9H2,1-3H3,(H,16,23)
InChIKeyHDOFNSFFUDMNBU-UHFFFAOYSA-N
MW313.37 g/mol
LogP0.88
Rot. Bonds5

About N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide

N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide (PubChem CID 91782573) has the molecular formula C15H19N7O and a molecular weight of 313.37 g/mol. Its IUPAC name is N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
PubChem CID91782573
Molecular FormulaC15H19N7O
Molecular Weight313.37 g/mol
Exact Mass313.17
IUPAC NameN-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide
SMILESCc1ccc2c(c1)c(CNC(=O)CCn1nnnc1C)nn2C
InChIInChI=1S/C15H19N7O/c1-10-4-5-14-12(8-10)13(18-21(14)3)9-16-15(23)6-7-22-11(2)17-19-20-22/h4-5,8H,6-7,9H2,1-3H3,(H,16,23)
InChIKeyHDOFNSFFUDMNBU-UHFFFAOYSA-N
XLogP0.88
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(1,5-dimethylindazol-3-yl)methyl]-1-methyl-5-oxo-4H-1,2,4-triazole-3-carboxamide
CID 157017185
N-[(1,5-dimethylindazol-3-yl)methyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 122558835
N-[(1,5-dimethylindazol-3-yl)methyl]-2-[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]acetamide
CID 125176476
(3S)-N-[(1,5-dimethylindazol-3-yl)methyl]-2-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 97187456
N-[(1,5-dimethylindazol-3-yl)methyl]cyclohex-3-ene-1-carboxamide
CID 122563829
1-(cyclopropanecarbonyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide
CID 72852922
(5S)-N-[(1,5-dimethylindazol-3-yl)methyl]-3-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 95200527
1-cyclopropyl-N-[(1,5-dimethylindazol-3-yl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172664883
1-cyclopropyl-N-[(1,5-dimethylindazol-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 70775694
2-(6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-[(1,5-dimethylindazol-3-yl)methyl]acetamide
CID 91785917
ethyl 4-[(1,5-dimethylindazol-3-yl)methylamino]piperidine-1-carboxylate
CID 50951872
(3R)-1-cyclopentyl-N-[(1,5-dimethylindazol-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 97118436

Frequently Asked Questions

What is the IUPAC name of N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
The IUPAC name of N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide (CID 91782573) is N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide.
What is the SMILES notation for N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
The canonical SMILES for N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide is Cc1ccc2c(c1)c(CNC(=O)CCn1nnnc1C)nn2C.
What is the InChIKey of N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
The InChIKey is HDOFNSFFUDMNBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7O/c1-10-4-5-14-12(8-10)13(18-21(14)3)9-16-15(23)6-7-22-11(2)17-19-20-22/h4-5,8H,6-7,9H2,1-3H3,(H,16,23).
What are the key properties of N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide?
N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide has a molecular weight of 313.37 g/mol, XLogP of 0.88, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylindazol-3-yl)methyl]-3-(5-methyltetrazol-1-yl)propanamide is sourced from PubChem (CID 91782573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).