N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide

C20H26N2O2 — CID 171631480

IUPACN-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide
SMILESC[C@H](NC(=O)c1ccc(C2CC2)cc1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C20H26N2O2/c1-14(19(24)22-12-10-20(8-9-20)11-13-22)21-18(23)17-6-4-16(5-7-17)15-2-3-15/h4-7,14-15H,2-3,8-13H2,1H3,(H,21,23)/t14-/m0/s1
InChIKeyRNOUZESLAYMNRU-AWEZNQCLSA-N
MW326.44 g/mol
LogP3.08
Rot. Bonds4

About N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide

N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide (PubChem CID 171631480) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide.

Molecular Properties

Compound NameN-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide
PubChem CID171631480
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide
SMILESC[C@H](NC(=O)c1ccc(C2CC2)cc1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C20H26N2O2/c1-14(19(24)22-12-10-20(8-9-20)11-13-22)21-18(23)17-6-4-16(5-7-17)15-2-3-15/h4-7,14-15H,2-3,8-13H2,1H3,(H,21,23)/t14-/m0/s1
InChIKeyRNOUZESLAYMNRU-AWEZNQCLSA-N
XLogP3.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide with MolForge

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Related Compounds

N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-(2,2-difluorocyclopropyl)benzamide
CID 171631173
N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-cyclopropylpyridine-3-carboxamide
CID 171631062
N-[1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide
CID 171631075
N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-2-[(1S,2S)-2-methylcyclopropyl]pyrimidine-5-carboxamide
CID 171631065
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 171631270
4-cyclobutyl-N-propan-2-ylbenzamide
CID 174282086
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)benzamide
CID 171631157
2-[(4-cyclopentylbenzoyl)amino]propanoic acid
CID 110466073
N-[1-(4-hydroxy-4-methylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide
CID 80702651
N-[(2R)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-6-chloroquinoline-3-carboxamide
CID 174373909
2-[(4-cyclohexylbenzoyl)amino]propanoic acid
CID 110466195
methyl 2-[(4-cyclopentylbenzoyl)amino]propanoate
CID 110487402

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide?
The IUPAC name of N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide (CID 171631480) is N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide.
What is the SMILES notation for N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide?
The canonical SMILES for N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide is C[C@H](NC(=O)c1ccc(C2CC2)cc1)C(=O)N1CCC2(CC1)CC2.
What is the InChIKey of N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide?
The InChIKey is RNOUZESLAYMNRU-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-14(19(24)22-12-10-20(8-9-20)11-13-22)21-18(23)17-6-4-16(5-7-17)15-2-3-15/h4-7,14-15H,2-3,8-13H2,1H3,(H,21,23)/t14-/m0/s1.
What are the key properties of N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide?
N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide has a molecular weight of 326.44 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide is sourced from PubChem (CID 171631480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).