N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide

C21H20N4O — CID 95156658

IUPACN-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide
SMILESO=C(c1ccc(-n2ccnc2)nc1)N(C1CC1)[C@H]1CCc2ccccc21
InChIInChI=1S/C21H20N4O/c26-21(16-6-10-20(23-13-16)24-12-11-22-14-24)25(17-7-8-17)19-9-5-15-3-1-2-4-18(15)19/h1-4,6,10-14,17,19H,5,7-9H2/t19-/m0/s1
InChIKeyCEJSESXVAFEMOT-IBGZPJMESA-N
MW344.42 g/mol
LogP3.56
Rot. Bonds4

About N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide

N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide (PubChem CID 95156658) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide
PubChem CID95156658
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC NameN-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide
SMILESO=C(c1ccc(-n2ccnc2)nc1)N(C1CC1)[C@H]1CCc2ccccc21
InChIInChI=1S/C21H20N4O/c26-21(16-6-10-20(23-13-16)24-12-11-22-14-24)25(17-7-8-17)19-9-5-15-3-1-2-4-18(15)19/h1-4,6,10-14,17,19H,5,7-9H2/t19-/m0/s1
InChIKeyCEJSESXVAFEMOT-IBGZPJMESA-N
XLogP3.56
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide with MolForge

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Related Compounds

6-imidazol-1-yl-N-propyl-N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 94648066
N-(2,3-dihydro-1H-inden-1-yl)-2-imidazol-1-yl-N-methylpyridine-4-carboxamide
CID 51085905
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 94018271
4-(cyclopropanecarbonylamino)-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 71885135
N-cyclopropyl-N-[(1R)-2,3-dihydro-1H-inden-1-yl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 94809213
N-cyclopropyl-4-pyrazol-1-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 55592536
N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 51647219
2-imidazol-1-yl-N-methyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-4-carboxamide
CID 94816782
N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-4-methylsulfinylbenzamide
CID 56822012
(4-hydroxypiperidin-1-yl)-(6-imidazol-1-yl-3-pyridinyl)methanone
CID 43417527
N-(2-aminoethyl)-6-imidazol-1-yl-N-methylpyridine-3-carboxamide;methanamine
CID 142231842
2-N,2-N,5-N,5-N-tetrakis(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-2,5-dicarboxamide
CID 54416285

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide (CID 95156658) is N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide is O=C(c1ccc(-n2ccnc2)nc1)N(C1CC1)[C@H]1CCc2ccccc21.
What is the InChIKey of N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide?
The InChIKey is CEJSESXVAFEMOT-IBGZPJMESA-N. The full InChI is InChI=1S/C21H20N4O/c26-21(16-6-10-20(23-13-16)24-12-11-22-14-24)25(17-7-8-17)19-9-5-15-3-1-2-4-18(15)19/h1-4,6,10-14,17,19H,5,7-9H2/t19-/m0/s1.
What are the key properties of N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide?
N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-6-imidazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 95156658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).