N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide

C13H26N2O2 — CID 60953799

IUPACN-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide
SMILESCC(C)NCCC(=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-11(2)14-8-7-13(17)15(9-10-16)12-5-3-4-6-12/h11-12,14,16H,3-10H2,1-2H3
InChIKeyCBLCQWCPBBQGRE-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.14
Rot. Bonds7

About N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide

N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide (PubChem CID 60953799) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide
PubChem CID60953799
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide
SMILESCC(C)NCCC(=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-11(2)14-8-7-13(17)15(9-10-16)12-5-3-4-6-12/h11-12,14,16H,3-10H2,1-2H3
InChIKeyCBLCQWCPBBQGRE-UHFFFAOYSA-N
XLogP1.14
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclobutyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide
CID 102862058
3-[cyclopropyl-[3-(propan-2-ylamino)propanoyl]amino]propanoic acid
CID 61160293
N-cyclopentyl-N-(2-hydroxyethyl)-4-(methylamino)butanamide
CID 60953691
N-cyclobutyl-N-(2-hydroxyethyl)-4-(methylamino)butanamide
CID 102862127
N-cyclobutyl-3-(cyclopropylamino)-N-(2-hydroxyethyl)propanamide
CID 102862128
N-cyclopentyl-N-(2-hydroxyethyl)-3-oxobutanamide
CID 60952245
N-cyclopentyl-N-(2-hydroxyethyl)-3-sulfanylpropanamide
CID 107026376
3-bromo-N-cyclobutyl-N-(2-hydroxyethyl)propanamide
CID 102861214
N-cyclohexyl-N-(2-hydroxyethyl)-3-methylsulfonylpropanamide
CID 54942745
N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methyl-3-(propan-2-ylamino)propanamide
CID 60962542
6-[cyclohexyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 54875131
4-amino-N-cyclobutyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 102862103

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide?
The IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide (CID 60953799) is N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide.
What is the SMILES notation for N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide?
The canonical SMILES for N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide is CC(C)NCCC(=O)N(CCO)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide?
The InChIKey is CBLCQWCPBBQGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-11(2)14-8-7-13(17)15(9-10-16)12-5-3-4-6-12/h11-12,14,16H,3-10H2,1-2H3.
What are the key properties of N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide?
N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide has a molecular weight of 242.36 g/mol, XLogP of 1.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide is sourced from PubChem (CID 60953799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).