1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide

C14H26N2O2 — CID 114948730

IUPAC1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide
SMILESCC1CC(CN)(C(=O)N(C)CC2(O)CCCC2)C1
InChIInChI=1S/C14H26N2O2/c1-11-7-13(8-11,9-15)12(17)16(2)10-14(18)5-3-4-6-14/h11,18H,3-10,15H2,1-2H3
InChIKeyUXVOFDNYTGRJAT-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.12
Rot. Bonds4

About 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide

1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide (PubChem CID 114948730) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide
PubChem CID114948730
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide
SMILESCC1CC(CN)(C(=O)N(C)CC2(O)CCCC2)C1
InChIInChI=1S/C14H26N2O2/c1-11-7-13(8-11,9-15)12(17)16(2)10-14(18)5-3-4-6-14/h11,18H,3-10,15H2,1-2H3
InChIKeyUXVOFDNYTGRJAT-UHFFFAOYSA-N
XLogP1.12
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide (CID 114948730) is 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide is CC1CC(CN)(C(=O)N(C)CC2(O)CCCC2)C1.
What is the InChIKey of 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide?
The InChIKey is UXVOFDNYTGRJAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11-7-13(8-11,9-15)12(17)16(2)10-14(18)5-3-4-6-14/h11,18H,3-10,15H2,1-2H3.
What are the key properties of 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide?
1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 114948730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).