3-[(4-hydroxycyclohexyl)amino]butanamide

C10H20N2O2 — CID 45281355

IUPAC3-[(4-hydroxycyclohexyl)amino]butanamide
SMILESCC(CC(N)=O)NC1CCC(O)CC1
InChIInChI=1S/C10H20N2O2/c1-7(6-10(11)14)12-8-2-4-9(13)5-3-8/h7-9,12-13H,2-6H2,1H3,(H2,11,14)
InChIKeyJFFWUYFQBBSQFB-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.14
Rot. Bonds4

About 3-[(4-hydroxycyclohexyl)amino]butanamide

3-[(4-hydroxycyclohexyl)amino]butanamide (PubChem CID 45281355) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-[(4-hydroxycyclohexyl)amino]butanamide.

Molecular Properties

Compound Name3-[(4-hydroxycyclohexyl)amino]butanamide
PubChem CID45281355
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-[(4-hydroxycyclohexyl)amino]butanamide
SMILESCC(CC(N)=O)NC1CCC(O)CC1
InChIInChI=1S/C10H20N2O2/c1-7(6-10(11)14)12-8-2-4-9(13)5-3-8/h7-9,12-13H,2-6H2,1H3,(H2,11,14)
InChIKeyJFFWUYFQBBSQFB-UHFFFAOYSA-N
XLogP0.14
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(1-methylpiperidin-4-yl)amino]butanamide
CID 115572762
3-[(1-propan-2-ylpiperidin-4-yl)amino]butanamide
CID 115572761
3-[[1-(3-methylbut-2-enyl)piperidin-4-yl]amino]butanamide
CID 113250232
4-(1-cyclobutylpropan-2-ylamino)cyclohexan-1-ol
CID 103904559
4-(1-cyclopentylpropan-2-ylamino)cyclohexan-1-ol
CID 103904582
3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]butanamide
CID 104585278
4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol
CID 62535244
3-[[3-(trifluoromethyl)cyclohexyl]amino]butanamide
CID 113250164
4-(pent-4-yn-2-ylamino)cyclohexan-1-ol
CID 106595148
3-[(3-phenylcyclobutyl)amino]butanamide
CID 115676859
4-(hex-5-en-2-ylamino)cyclohexan-1-ol
CID 75525485
(2S)-2-(cyclopropylamino)propanamide
CID 28835909

Frequently Asked Questions

What is the IUPAC name of 3-[(4-hydroxycyclohexyl)amino]butanamide?
The IUPAC name of 3-[(4-hydroxycyclohexyl)amino]butanamide (CID 45281355) is 3-[(4-hydroxycyclohexyl)amino]butanamide.
What is the SMILES notation for 3-[(4-hydroxycyclohexyl)amino]butanamide?
The canonical SMILES for 3-[(4-hydroxycyclohexyl)amino]butanamide is CC(CC(N)=O)NC1CCC(O)CC1.
What is the InChIKey of 3-[(4-hydroxycyclohexyl)amino]butanamide?
The InChIKey is JFFWUYFQBBSQFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(6-10(11)14)12-8-2-4-9(13)5-3-8/h7-9,12-13H,2-6H2,1H3,(H2,11,14).
What are the key properties of 3-[(4-hydroxycyclohexyl)amino]butanamide?
3-[(4-hydroxycyclohexyl)amino]butanamide has a molecular weight of 200.28 g/mol, XLogP of 0.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-hydroxycyclohexyl)amino]butanamide is sourced from PubChem (CID 45281355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).