2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide

C14H29N3O — CID 63054490

IUPAC2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide
SMILESCCNC(CCN(C)C1CCC(C)CC1)C(N)=O
InChIInChI=1S/C14H29N3O/c1-4-16-13(14(15)18)9-10-17(3)12-7-5-11(2)6-8-12/h11-13,16H,4-10H2,1-3H3,(H2,15,18)
InChIKeyYYXUMQWZJXYCRF-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds7

About 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide

2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide (PubChem CID 63054490) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide.

Molecular Properties

Compound Name2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide
PubChem CID63054490
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide
SMILESCCNC(CCN(C)C1CCC(C)CC1)C(N)=O
InChIInChI=1S/C14H29N3O/c1-4-16-13(14(15)18)9-10-17(3)12-7-5-11(2)6-8-12/h11-13,16H,4-10H2,1-3H3,(H2,15,18)
InChIKeyYYXUMQWZJXYCRF-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[cyclopropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63027258
4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide
CID 63028816
4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanoic acid
CID 63027278
methyl 2-(cyclopropylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanoate
CID 63055370
4-[(4-ethylcyclohexyl)-methylamino]-2-(propan-2-ylamino)butanamide
CID 63054146
2-(ethylamino)-4-[ethyl(methyl)amino]butanamide
CID 63029588
4-[butyl(methyl)amino]-2-(ethylamino)butanamide
CID 63029682
4-[cyclopropyl(cyclopropylmethyl)amino]-2-(propylamino)butanamide
CID 64521638
2-(ethylamino)-4-[methyl(pentan-3-yl)amino]butanamide
CID 63030006
4-[2,2-dimethylpropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63055540
4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide
CID 63029394
4-[butan-2-yl(ethyl)amino]-2-(ethylamino)butanamide
CID 63027471

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide?
The IUPAC name of 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide (CID 63054490) is 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide.
What is the SMILES notation for 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide?
The canonical SMILES for 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide is CCNC(CCN(C)C1CCC(C)CC1)C(N)=O.
What is the InChIKey of 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide?
The InChIKey is YYXUMQWZJXYCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-4-16-13(14(15)18)9-10-17(3)12-7-5-11(2)6-8-12/h11-13,16H,4-10H2,1-3H3,(H2,15,18).
What are the key properties of 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide?
2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide is sourced from PubChem (CID 63054490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).