2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide

C13H26N2O2 — CID 106360844

IUPAC2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)NC1CCCC1CO
InChIInChI=1S/C13H26N2O2/c1-9(2)7-14-13(17)10(3)15-12-6-4-5-11(12)8-16/h9-12,15-16H,4-8H2,1-3H3,(H,14,17)
InChIKeyHQYORMSIVDYECF-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.90
Rot. Bonds6

About 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide

2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide (PubChem CID 106360844) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide
PubChem CID106360844
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)NC1CCCC1CO
InChIInChI=1S/C13H26N2O2/c1-9(2)7-14-13(17)10(3)15-12-6-4-5-11(12)8-16/h9-12,15-16H,4-8H2,1-3H3,(H,14,17)
InChIKeyHQYORMSIVDYECF-UHFFFAOYSA-N
XLogP0.90
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-propan-2-ylpropanamide
CID 106361170
2-(cyclohexylamino)-N-(2-methylpropyl)propanamide
CID 43086810
(2S)-2-[[(1S,2R)-2-(hydroxymethyl)cyclohexyl]amino]-N-methyl-N-propan-2-ylpropanamide
CID 129435663
(2S)-2-[[(1R,2S)-2-(hydroxymethyl)cyclohexyl]amino]-N-methyl-N-propan-2-ylpropanamide
CID 99609371
3-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylbutanoic acid
CID 106360781
[2-(1-cyclopentylethylamino)cyclopentyl]methanol
CID 115723803
2-[[(1R)-1-cyclopentylethyl]amino]-N-(2-methylpropyl)propanamide
CID 81393775
[2-(1-cyclopropylpropan-2-ylamino)cyclopentyl]methanol
CID 115723777
[2-(2-methylpentan-3-ylamino)cyclopentyl]methanol
CID 115723783
3-[[2-(hydroxymethyl)cyclohexyl]amino]butan-2-ol
CID 104934399
2-[[(1R)-1-cyclohexylethyl]amino]-N-(2-methylpropyl)propanamide
CID 81385143
2-methylpropyl N-[2-(hydroxymethyl)cyclopentyl]carbamate
CID 106364581

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide (CID 106360844) is 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide is CC(C)CNC(=O)C(C)NC1CCCC1CO.
What is the InChIKey of 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide?
The InChIKey is HQYORMSIVDYECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-9(2)7-14-13(17)10(3)15-12-6-4-5-11(12)8-16/h9-12,15-16H,4-8H2,1-3H3,(H,14,17).
What are the key properties of 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide?
2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide has a molecular weight of 242.36 g/mol, XLogP of 0.90, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(hydroxymethyl)cyclopentyl]amino]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 106360844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).