3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide

C11H22N2O2 — CID 65106819

IUPAC3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
SMILESCC(CN)C(=O)NCC1(O)CCCCC1
InChIInChI=1S/C11H22N2O2/c1-9(7-12)10(14)13-8-11(15)5-3-2-4-6-11/h9,15H,2-8,12H2,1H3,(H,13,14)
InChIKeySCYFRYOMRZCNOG-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.39
Rot. Bonds4

About 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide

3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide (PubChem CID 65106819) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide.

Molecular Properties

Compound Name3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
PubChem CID65106819
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
SMILESCC(CN)C(=O)NCC1(O)CCCCC1
InChIInChI=1S/C11H22N2O2/c1-9(7-12)10(14)13-8-11(15)5-3-2-4-6-11/h9,15H,2-8,12H2,1H3,(H,13,14)
InChIKeySCYFRYOMRZCNOG-UHFFFAOYSA-N
XLogP0.39
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 ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 58767519
(2S)-2-amino-N-[(1-hydroxycyclohexyl)methyl]-3-methylbutanamide
CID 65106150
3-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-2-methylpropanamide
CID 106101303
N-[(1-hydroxycyclohexyl)methyl]-4-methoxy-2-methylbutanamide
CID 111539886
2-chloro-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 65105224
4-[(1-hydroxycyclohexyl)methylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498630
2-amino-N-[(1-hydroxycycloheptyl)methyl]-3,3-dimethylbutanamide
CID 77056764
(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 111840753
N-[(1-hydroxycyclopentyl)methyl]-2-methylsulfonylpropanamide
CID 115626883
2-amino-N-[(1-hydroxycyclopentyl)methyl]-3,3-dimethylbutanamide
CID 77210747
2-amino-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 65122282
2-ethoxy-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 111331443

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide?
The IUPAC name of 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide (CID 65106819) is 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide.
What is the SMILES notation for 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide?
The canonical SMILES for 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide is CC(CN)C(=O)NCC1(O)CCCCC1.
What is the InChIKey of 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide?
The InChIKey is SCYFRYOMRZCNOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(7-12)10(14)13-8-11(15)5-3-2-4-6-11/h9,15H,2-8,12H2,1H3,(H,13,14).
What are the key properties of 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide?
3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.39, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide is sourced from PubChem (CID 65106819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).