N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride

C18H25ClN4O — CID 175904542

IUPACN-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride
SMILESCc1cccn2c(C(C)(C)NC(=O)C3CC34CCNC4)ncc12.Cl
InChIInChI=1S/C18H24N4O.ClH/c1-12-5-4-8-22-14(12)10-20-16(22)17(2,3)21-15(23)13-9-18(13)6-7-19-11-18;/h4-5,8,10,13,19H,6-7,9,11H2,1-3H3,(H,21,23);1H
InChIKeyGBQNNQMTACNZCC-UHFFFAOYSA-N
MW348.88 g/mol
LogP2.42
Rot. Bonds3

About N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride

N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride (PubChem CID 175904542) has the molecular formula C18H25ClN4O and a molecular weight of 348.88 g/mol. Its IUPAC name is N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride
PubChem CID175904542
Molecular FormulaC18H25ClN4O
Molecular Weight348.88 g/mol
Exact Mass348.17
IUPAC NameN-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride
SMILESCc1cccn2c(C(C)(C)NC(=O)C3CC34CCNC4)ncc12.Cl
InChIInChI=1S/C18H24N4O.ClH/c1-12-5-4-8-22-14(12)10-20-16(22)17(2,3)21-15(23)13-9-18(13)6-7-19-11-18;/h4-5,8,10,13,19H,6-7,9,11H2,1-3H3,(H,21,23);1H
InChIKeyGBQNNQMTACNZCC-UHFFFAOYSA-N
XLogP2.42
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.88
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride (CID 175904542) is N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride is Cc1cccn2c(C(C)(C)NC(=O)C3CC34CCNC4)ncc12.Cl.
What is the InChIKey of N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride?
The InChIKey is GBQNNQMTACNZCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O.ClH/c1-12-5-4-8-22-14(12)10-20-16(22)17(2,3)21-15(23)13-9-18(13)6-7-19-11-18;/h4-5,8,10,13,19H,6-7,9,11H2,1-3H3,(H,21,23);1H.
What are the key properties of N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride?
N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride has a molecular weight of 348.88 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-5-azaspiro[2.4]heptane-2-carboxamide;hydrochloride is sourced from PubChem (CID 175904542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).