(7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

C17H23N5O — CID 164641954

IUPAC(7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCc1ncc2n1CC[C@H](C(=O)Nc1cnn(C3CCCC3)c1)C2
InChIInChI=1S/C17H23N5O/c1-12-18-10-16-8-13(6-7-21(12)16)17(23)20-14-9-19-22(11-14)15-4-2-3-5-15/h9-11,13,15H,2-8H2,1H3,(H,20,23)/t13-/m0/s1
InChIKeyJQMDTOVWIBTTQW-ZDUSSCGKSA-N
MW313.40 g/mol
LogP2.70
Rot. Bonds3

About (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

(7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (PubChem CID 164641954) has the molecular formula C17H23N5O and a molecular weight of 313.40 g/mol. Its IUPAC name is (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound Name(7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
PubChem CID164641954
Molecular FormulaC17H23N5O
Molecular Weight313.40 g/mol
Exact Mass313.19
IUPAC Name(7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCc1ncc2n1CC[C@H](C(=O)Nc1cnn(C3CCCC3)c1)C2
InChIInChI=1S/C17H23N5O/c1-12-18-10-16-8-13(6-7-21(12)16)17(23)20-14-9-19-22(11-14)15-4-2-3-5-15/h9-11,13,15H,2-8H2,1H3,(H,20,23)/t13-/m0/s1
InChIKeyJQMDTOVWIBTTQW-ZDUSSCGKSA-N
XLogP2.70
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (CID 164641954) is (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is Cc1ncc2n1CC[C@H](C(=O)Nc1cnn(C3CCCC3)c1)C2.
What is the InChIKey of (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The InChIKey is JQMDTOVWIBTTQW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H23N5O/c1-12-18-10-16-8-13(6-7-21(12)16)17(23)20-14-9-19-22(11-14)15-4-2-3-5-15/h9-11,13,15H,2-8H2,1H3,(H,20,23)/t13-/m0/s1.
What are the key properties of (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
(7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-N-(1-cyclopentylpyrazol-4-yl)-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 164641954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).