2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide

C14H26N2O — CID 62782345

IUPAC2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide
SMILESNC1CCC(CC(=O)NCC2CCCC2)CC1
InChIInChI=1S/C14H26N2O/c15-13-7-5-11(6-8-13)9-14(17)16-10-12-3-1-2-4-12/h11-13H,1-10,15H2,(H,16,17)
InChIKeyPGTKEBWNFIGGQD-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.20
Rot. Bonds4

About 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide

2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide (PubChem CID 62782345) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide
PubChem CID62782345
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide
SMILESNC1CCC(CC(=O)NCC2CCCC2)CC1
InChIInChI=1S/C14H26N2O/c15-13-7-5-11(6-8-13)9-14(17)16-10-12-3-1-2-4-12/h11-13H,1-10,15H2,(H,16,17)
InChIKeyPGTKEBWNFIGGQD-UHFFFAOYSA-N
XLogP2.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide?
The IUPAC name of 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide (CID 62782345) is 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide.
What is the SMILES notation for 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide?
The canonical SMILES for 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide is NC1CCC(CC(=O)NCC2CCCC2)CC1.
What is the InChIKey of 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide?
The InChIKey is PGTKEBWNFIGGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c15-13-7-5-11(6-8-13)9-14(17)16-10-12-3-1-2-4-12/h11-13H,1-10,15H2,(H,16,17).
What are the key properties of 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide?
2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide has a molecular weight of 238.37 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminocyclohexyl)-N-(cyclopentylmethyl)acetamide is sourced from PubChem (CID 62782345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).