(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide

C12H24N2O — CID 78966012

IUPAC(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide
SMILESCC1CCCC(CCNC(=O)[C@@H](C)N)C1
InChIInChI=1S/C12H24N2O/c1-9-4-3-5-11(8-9)6-7-14-12(15)10(2)13/h9-11H,3-8,13H2,1-2H3,(H,14,15)/t9?,10-,11?/m1/s1
InChIKeyGXXZRMUUMGRYDR-HSOILSAZSA-N
MW212.34 g/mol
LogP1.67
Rot. Bonds4

About (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide

(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide (PubChem CID 78966012) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide
PubChem CID78966012
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide
SMILESCC1CCCC(CCNC(=O)[C@@H](C)N)C1
InChIInChI=1S/C12H24N2O/c1-9-4-3-5-11(8-9)6-7-14-12(15)10(2)13/h9-11H,3-8,13H2,1-2H3,(H,14,15)/t9?,10-,11?/m1/s1
InChIKeyGXXZRMUUMGRYDR-HSOILSAZSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2-cyclobutylethyl)propanamide
CID 103797223
(2S)-2-amino-3-methyl-N-[2-(3-methylcyclohexyl)ethyl]butanamide;hydrochloride
CID 119323315
2-amino-N-[2-(3-methylcyclohexyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120793045
1-methoxy-3-[2-[(1S,3S)-3-methylcyclohexyl]ethyl]urea
CID 95628739
(2R)-4-methyl-2-[2-(3-methylcyclohexyl)ethylcarbamoylamino]pentanoic acid
CID 78965782
2-hydroxy-2-methyl-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 103430075
2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride
CID 119783122
2-amino-3-methyl-N-[(3-methylcyclohexyl)methyl]butanamide
CID 103795901
2-amino-N-[2-(3-methylcyclohexyl)ethyl]-2-(1-methylpyrazol-4-yl)acetamide
CID 115290762
(2S)-2-amino-N-(3-cyclopentylpropyl)propanamide
CID 103795255
1-(4-hydroxy-2-methylpentyl)-3-[2-(3-methylcyclohexyl)ethyl]urea
CID 111455561
3-bromo-N-[2-(3-methylcyclohexyl)ethyl]prop-2-ynamide
CID 130918142

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide (CID 78966012) is (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide is CC1CCCC(CCNC(=O)[C@@H](C)N)C1.
What is the InChIKey of (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide?
The InChIKey is GXXZRMUUMGRYDR-HSOILSAZSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9-4-3-5-11(8-9)6-7-14-12(15)10(2)13/h9-11H,3-8,13H2,1-2H3,(H,14,15)/t9?,10-,11?/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide?
(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide has a molecular weight of 212.34 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide is sourced from PubChem (CID 78966012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).