2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide

C14H28N2O — CID 64679470

IUPAC2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide
SMILESCCCC(CC)NC(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H28N2O/c1-3-8-12(4-2)16-13(17)11-14(15)9-6-5-7-10-14/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeySHCVBTFIQJZOCE-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.73
Rot. Bonds6

About 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide

2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide (PubChem CID 64679470) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide
PubChem CID64679470
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide
SMILESCCCC(CC)NC(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H28N2O/c1-3-8-12(4-2)16-13(17)11-14(15)9-6-5-7-10-14/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeySHCVBTFIQJZOCE-UHFFFAOYSA-N
XLogP2.73
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide
CID 64677686
2-(1-aminocyclopentyl)-N-[(2S)-1-hydroxybutan-2-yl]acetamide
CID 107222528
2-(1-aminocyclopentyl)-N-(1-hydroxybutan-2-yl)acetamide
CID 64685767
2-(1-aminocyclopentyl)-N-(1-methoxybutan-2-yl)acetamide
CID 64677485
2-(1-aminocyclobutyl)-N-(1-cyclopropylbutan-2-yl)acetamide
CID 79853622
2-(1-aminocyclopentyl)-N-(1-cyanobutan-2-yl)acetamide
CID 64679480
(2S)-2-[[2-(1-aminocyclopentyl)acetyl]amino]pentanoic acid
CID 107565076
1-[2-(hexan-3-ylamino)-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 62119087
2-(1-aminocyclohexyl)-N-(2-methylpentan-3-yl)acetamide
CID 64678828
2-(1-aminocyclopentyl)-N-(3-ethylpentan-2-yl)acetamide
CID 64676880
(2S,3S)-2-[[2-(1-aminocyclohexyl)acetyl]amino]-3-methylpentanoic acid
CID 64678791
2-[[2-(1-aminocyclohexyl)acetyl]amino]-N-propylpropanamide
CID 64684814

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide (CID 64679470) is 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide is CCCC(CC)NC(=O)CC1(N)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide?
The InChIKey is SHCVBTFIQJZOCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-8-12(4-2)16-13(17)11-14(15)9-6-5-7-10-14/h12H,3-11,15H2,1-2H3,(H,16,17).
What are the key properties of 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide?
2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide has a molecular weight of 240.39 g/mol, XLogP of 2.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide is sourced from PubChem (CID 64679470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).