4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide

C11H22N2O2 — CID 107221714

IUPAC4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide
SMILESCC(N)CCC(=O)N[C@H]1CCCC[C@@H]1O
InChIInChI=1S/C11H22N2O2/c1-8(12)6-7-11(15)13-9-4-2-3-5-10(9)14/h8-10,14H,2-7,12H2,1H3,(H,13,15)/t8?,9-,10-/m0/s1
InChIKeyPCPIHNFFQGYRKK-AGROOBSYSA-N
MW214.31 g/mol
LogP0.53
Rot. Bonds4

About 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide

4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide (PubChem CID 107221714) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide
PubChem CID107221714
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide
SMILESCC(N)CCC(=O)N[C@H]1CCCC[C@@H]1O
InChIInChI=1S/C11H22N2O2/c1-8(12)6-7-11(15)13-9-4-2-3-5-10(9)14/h8-10,14H,2-7,12H2,1H3,(H,13,15)/t8?,9-,10-/m0/s1
InChIKeyPCPIHNFFQGYRKK-AGROOBSYSA-N
XLogP0.53
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-4-phenylbutanamide
CID 107222076
2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid
CID 64812288
N-[(1R,2S)-2-hydroxycyclohexyl]-N'-[(1S,2R)-2-hydroxycyclohexyl]hexanediamide
CID 40600214
N-[(1R,2R)-2-hydroxycyclohexyl]-3-propan-2-yloxypropanamide
CID 97245059
N-(2-hydroxycyclopentyl)butanamide
CID 72951810
5-amino-N-[2-(hydroxymethyl)cyclohexyl]hexanamide
CID 106361473
N-[(1S,2S)-2-hydroxycyclopentyl]butanamide;hydrochloride
CID 71419667
6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide
CID 107221663
4-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]butanamide
CID 107216783
5-hydroxy-N-(2-hydroxycyclohexyl)pentanamide
CID 79199015
2-hydroxy-N-[(1R,2R)-2-hydroxycycloheptyl]acetamide
CID 130693023
methyl 5-[[(1R,2R)-2-hydroxycyclohexyl]amino]-5-oxopentanoate
CID 10900833

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide?
The IUPAC name of 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide (CID 107221714) is 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide.
What is the SMILES notation for 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide?
The canonical SMILES for 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide is CC(N)CCC(=O)N[C@H]1CCCC[C@@H]1O.
What is the InChIKey of 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide?
The InChIKey is PCPIHNFFQGYRKK-AGROOBSYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-8(12)6-7-11(15)13-9-4-2-3-5-10(9)14/h8-10,14H,2-7,12H2,1H3,(H,13,15)/t8?,9-,10-/m0/s1.
What are the key properties of 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide?
4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide has a molecular weight of 214.31 g/mol, XLogP of 0.53, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide is sourced from PubChem (CID 107221714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).