(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide

C11H22N2O — CID 103798136

IUPAC(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
SMILESC[C@@H](N)C(=O)NCC1(C)CCCCC1
InChIInChI=1S/C11H22N2O/c1-9(12)10(14)13-8-11(2)6-4-3-5-7-11/h9H,3-8,12H2,1-2H3,(H,13,14)/t9-/m1/s1
InChIKeyGTCVNIMJVTWWIV-SECBINFHSA-N
MW198.31 g/mol
LogP1.42
Rot. Bonds3

About (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide

(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide (PubChem CID 103798136) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
PubChem CID103798136
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
SMILESC[C@@H](N)C(=O)NCC1(C)CCCCC1
InChIInChI=1S/C11H22N2O/c1-9(12)10(14)13-8-11(2)6-4-3-5-7-11/h9H,3-8,12H2,1-2H3,(H,13,14)/t9-/m1/s1
InChIKeyGTCVNIMJVTWWIV-SECBINFHSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798125
3-amino-2-methyl-N-[(1-methylcyclohexyl)methyl]butanamide
CID 103581061
(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride
CID 119780580
2-methyl-N-[(1-methylcyclobutyl)methyl]propanamide
CID 103737357
(2S)-2-amino-N-[[1-(hydroxymethyl)cyclopentyl]methyl]propanamide
CID 115360089
2,2-difluoro-N-[(1-methylcyclopentyl)methyl]acetamide
CID 103515473
2-amino-N-[(1-methylcyclohexyl)methyl]hexanamide
CID 103832772
N-[(1-methylcycloheptyl)methyl]acetamide
CID 127751208
(2S)-2-amino-N-[(1-aminocyclobutyl)methyl]propanamide
CID 130736337
2-cyano-N-[(1-methylcyclopentyl)methyl]propanamide
CID 63829788
propan-2-yl N-[(1-methylcyclopentyl)methyl]carbamate
CID 116656090
2-[(Z)-N'-hydroxycarbamimidoyl]-3-methyl-N-[(1-methylcyclopentyl)methyl]butanamide
CID 63831085

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide (CID 103798136) is (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide is C[C@@H](N)C(=O)NCC1(C)CCCCC1.
What is the InChIKey of (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide?
The InChIKey is GTCVNIMJVTWWIV-SECBINFHSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(12)10(14)13-8-11(2)6-4-3-5-7-11/h9H,3-8,12H2,1-2H3,(H,13,14)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide?
(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide has a molecular weight of 198.31 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide is sourced from PubChem (CID 103798136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).