2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide

C12H24N2O2 — CID 64603110

IUPAC2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide
SMILESCOCCC(C)NC(=O)C1CCCCC1N
InChIInChI=1S/C12H24N2O2/c1-9(7-8-16-2)14-12(15)10-5-3-4-6-11(10)13/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyJNLNQMITLHCSTL-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.05
Rot. Bonds5

About 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide

2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide (PubChem CID 64603110) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide
PubChem CID64603110
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide
SMILESCOCCC(C)NC(=O)C1CCCCC1N
InChIInChI=1S/C12H24N2O2/c1-9(7-8-16-2)14-12(15)10-5-3-4-6-11(10)13/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyJNLNQMITLHCSTL-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-aminocyclohexanecarbonyl)amino]-4-methoxybutanoic acid
CID 64824444
2-amino-N-(4-methoxybutan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 64603719
methyl 3-[(2-aminocyclopentanecarbonyl)amino]butanoate
CID 119695162
4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide
CID 66237512
2-amino-N-(4-methylsulfinylbutan-2-yl)cyclohexane-1-carboxamide
CID 113493513
2-amino-N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 113407184
3-[(2-aminocyclopentanecarbonyl)amino]butanoic acid
CID 64824606
2-amino-N-[1-(dimethylamino)propan-2-yl]cycloheptane-1-carboxamide
CID 82937442
2-amino-N-(1-methoxypentan-2-yl)cyclopentane-1-carboxamide
CID 64850676
5-amino-N-(4-methoxybutan-2-yl)-2-methylcyclohexane-1-carboxamide
CID 64603308
2-amino-N-propan-2-ylcyclooctane-1-carboxamide;hydrochloride
CID 119668927
cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
CID 67437509

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide (CID 64603110) is 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide is COCCC(C)NC(=O)C1CCCCC1N.
What is the InChIKey of 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide?
The InChIKey is JNLNQMITLHCSTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9(7-8-16-2)14-12(15)10-5-3-4-6-11(10)13/h9-11H,3-8,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide?
2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64603110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).