2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide

C14H28N2O2 — CID 64677686

IUPAC2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide
SMILESCCCC(COC)NC(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H28N2O2/c1-3-7-12(11-18-2)16-13(17)10-14(15)8-5-4-6-9-14/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeyLWCUDVRGOCXTQW-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.97
Rot. Bonds7

About 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide

2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide (PubChem CID 64677686) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide
PubChem CID64677686
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide
SMILESCCCC(COC)NC(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H28N2O2/c1-3-7-12(11-18-2)16-13(17)10-14(15)8-5-4-6-9-14/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeyLWCUDVRGOCXTQW-UHFFFAOYSA-N
XLogP1.97
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclopentyl)-N-(1-methoxybutan-2-yl)acetamide
CID 64677485
2-(1-aminocyclohexyl)-N-hexan-3-ylacetamide
CID 64679470
(2S)-2-[[2-(1-aminocyclopentyl)acetyl]amino]pentanoic acid
CID 107565076
2-(1-aminocyclopentyl)-N-(1-hydroxybutan-2-yl)acetamide
CID 64685767
2-(1-aminocyclopentyl)-N-[(2S)-1-hydroxybutan-2-yl]acetamide
CID 107222528
2-[[2-(1-aminocyclohexyl)acetyl]amino]-5-methoxypentanoic acid
CID 81078638
(2S)-2-[[2-(1-aminocyclohexyl)acetyl]amino]-5-methoxy-5-oxopentanoic acid
CID 107824195
2-(1-aminocyclohexyl)-N-(2-methylpentan-3-yl)acetamide
CID 64678828
2-(1-aminocyclopentyl)-N-(1-cyanobutan-2-yl)acetamide
CID 64679480
(2S,3S)-2-[[2-(1-aminocyclohexyl)acetyl]amino]-3-methylpentanoic acid
CID 64678791
2-(1-aminocyclobutyl)-N-(1-cyclopropylbutan-2-yl)acetamide
CID 79853622
2-[[2-(1-aminocyclohexyl)acetyl]amino]-N-propylpropanamide
CID 64684814

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide (CID 64677686) is 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide is CCCC(COC)NC(=O)CC1(N)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide?
The InChIKey is LWCUDVRGOCXTQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-7-12(11-18-2)16-13(17)10-14(15)8-5-4-6-9-14/h12H,3-11,15H2,1-2H3,(H,16,17).
What are the key properties of 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide?
2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide has a molecular weight of 256.39 g/mol, XLogP of 1.97, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-(1-methoxypentan-2-yl)acetamide is sourced from PubChem (CID 64677686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).