(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

C19H32N2O3 — CID 99768198

IUPAC(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
SMILESCCCNC(=O)[C@@H]1CO[C@]2(CCC[C@@H](C)C2)N1C(=O)C1CCCC1
InChIInChI=1S/C19H32N2O3/c1-3-11-20-17(22)16-13-24-19(10-6-7-14(2)12-19)21(16)18(23)15-8-4-5-9-15/h14-16H,3-13H2,1-2H3,(H,20,22)/t14-,16+,19+/m1/s1
InChIKeyIPRWQYFFZSQQBH-ALKREAHSSA-N
MW336.48 g/mol
LogP2.84
Rot. Bonds4

About (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (PubChem CID 99768198) has the molecular formula C19H32N2O3 and a molecular weight of 336.48 g/mol. Its IUPAC name is (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound Name(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
PubChem CID99768198
Molecular FormulaC19H32N2O3
Molecular Weight336.48 g/mol
Exact Mass336.24
IUPAC Name(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
SMILESCCCNC(=O)[C@@H]1CO[C@]2(CCC[C@@H](C)C2)N1C(=O)C1CCCC1
InChIInChI=1S/C19H32N2O3/c1-3-11-20-17(22)16-13-24-19(10-6-7-14(2)12-19)21(16)18(23)15-8-4-5-9-15/h14-16H,3-13H2,1-2H3,(H,20,22)/t14-,16+,19+/m1/s1
InChIKeyIPRWQYFFZSQQBH-ALKREAHSSA-N
XLogP2.84
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 42669895
4-(cyclopentanecarbonyl)-8-methyl-N-(2-pyridin-2-ylethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 42882206
7-methyl-4-(2-phenylacetyl)-N-(pyridin-3-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 42820736
(3S,5R,7R)-4-(2,6-dimethoxybenzoyl)-7-methyl-N-(2-methylpropyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 97478096
(3R,5S,7R)-N-benzyl-4-(2-fluorobenzoyl)-7-methyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 98405136
4-(cyclopentanecarbonyl)-N-[(3-fluorophenyl)methyl]-8-methyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 42882209
4-(3-fluorobenzoyl)-8-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71955974
(3R,5R,7R)-4-(2-fluorobenzoyl)-7-methyl-N-[[(2R)-oxolan-2-yl]methyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 129423276
N-propylcyclooctanecarboxamide
CID 65022755
N-propylcyclohexanecarboxamide;hydrochloride
CID 174790388
4-(2-cyclopentyl-2-oxoethyl)-N-propylmorpholine-3-carboxamide
CID 104751046
1-[(3R,5S)-5-methyl-1-oxa-2-azaspiro[2.5]octan-2-yl]ethanone
CID 45086479

Frequently Asked Questions

What is the IUPAC name of (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The IUPAC name of (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (CID 99768198) is (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide is CCCNC(=O)[C@@H]1CO[C@]2(CCC[C@@H](C)C2)N1C(=O)C1CCCC1.
What is the InChIKey of (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The InChIKey is IPRWQYFFZSQQBH-ALKREAHSSA-N. The full InChI is InChI=1S/C19H32N2O3/c1-3-11-20-17(22)16-13-24-19(10-6-7-14(2)12-19)21(16)18(23)15-8-4-5-9-15/h14-16H,3-13H2,1-2H3,(H,20,22)/t14-,16+,19+/m1/s1.
What are the key properties of (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide has a molecular weight of 336.48 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 99768198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).