4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide

C15H29N3O2 — CID 62783394

IUPAC4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)C1CCC(N)C(C)C1
InChIInChI=1S/C15H29N3O2/c1-5-18(9-14(19)17-10(2)3)15(20)12-6-7-13(16)11(4)8-12/h10-13H,5-9,16H2,1-4H3,(H,17,19)
InChIKeyRGOVLWXABKUTOU-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.12
Rot. Bonds5

About 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide

4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide (PubChem CID 62783394) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
PubChem CID62783394
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)C1CCC(N)C(C)C1
InChIInChI=1S/C15H29N3O2/c1-5-18(9-14(19)17-10(2)3)15(20)12-6-7-13(16)11(4)8-12/h10-13H,5-9,16H2,1-4H3,(H,17,19)
InChIKeyRGOVLWXABKUTOU-UHFFFAOYSA-N
XLogP1.12
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
CID 64824749
N-ethyl-6-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide
CID 54985906
4-amino-N-butyl-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 62781326
4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 62777735
3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide
CID 62777554
3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
CID 66010622
4-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylcyclohexane-1-carboxamide
CID 103113502
2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide
CID 60703127
3-amino-N-ethyl-2-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 113416182
2-(3-aminocyclohexyl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 106592776
4-amino-N-[2-(dimethylamino)propyl]-3-methylcyclohexane-1-carboxamide
CID 62782736
4-amino-N-(3-ethylpentan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 63840862

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide (CID 62783394) is 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide is CCN(CC(=O)NC(C)C)C(=O)C1CCC(N)C(C)C1.
What is the InChIKey of 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide?
The InChIKey is RGOVLWXABKUTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-5-18(9-14(19)17-10(2)3)15(20)12-6-7-13(16)11(4)8-12/h10-13H,5-9,16H2,1-4H3,(H,17,19).
What are the key properties of 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide?
4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide has a molecular weight of 283.42 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 62783394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).