N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide

C19H25N3O2 — CID 171631062

IUPACN-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide
SMILESCC(NC(=O)c1ccc(C2CC2)nc1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C19H25N3O2/c1-13(18(24)22-10-8-19(6-7-19)9-11-22)21-17(23)15-4-5-16(20-12-15)14-2-3-14/h4-5,12-14H,2-3,6-11H2,1H3,(H,21,23)
InChIKeyKSNXJZJGEVAWBL-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.48
Rot. Bonds4

About N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide

N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide (PubChem CID 171631062) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide
PubChem CID171631062
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide
SMILESCC(NC(=O)c1ccc(C2CC2)nc1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C19H25N3O2/c1-13(18(24)22-10-8-19(6-7-19)9-11-22)21-17(23)15-4-5-16(20-12-15)14-2-3-14/h4-5,12-14H,2-3,6-11H2,1H3,(H,21,23)
InChIKeyKSNXJZJGEVAWBL-UHFFFAOYSA-N
XLogP2.48
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide?
The IUPAC name of N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide (CID 171631062) is N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide.
What is the SMILES notation for N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide?
The canonical SMILES for N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide is CC(NC(=O)c1ccc(C2CC2)nc1)C(=O)N1CCC2(CC1)CC2.
What is the InChIKey of N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide?
The InChIKey is KSNXJZJGEVAWBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-13(18(24)22-10-8-19(6-7-19)9-11-22)21-17(23)15-4-5-16(20-12-15)14-2-3-14/h4-5,12-14H,2-3,6-11H2,1H3,(H,21,23).
What are the key properties of N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide?
N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide is sourced from PubChem (CID 171631062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).