N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide

C12H22N2O — CID 115456696

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide
SMILESNCC1(CNC(=O)CC2CCCC2)CC1
InChIInChI=1S/C12H22N2O/c13-8-12(5-6-12)9-14-11(15)7-10-3-1-2-4-10/h10H,1-9,13H2,(H,14,15)
InChIKeyQBOBQCPJDODYTI-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.42
Rot. Bonds5

About N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide

N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide (PubChem CID 115456696) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide
PubChem CID115456696
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide
SMILESNCC1(CNC(=O)CC2CCCC2)CC1
InChIInChI=1S/C12H22N2O/c13-8-12(5-6-12)9-14-11(15)7-10-3-1-2-4-10/h10H,1-9,13H2,(H,14,15)
InChIKeyQBOBQCPJDODYTI-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)cyclopentyl]methyl]-2-cyclobutylacetamide
CID 103167014
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide
CID 103167045
2-[1-[[(2-cycloheptylacetyl)amino]methyl]cyclobutyl]acetic acid
CID 114457209
N-[[1-(bromomethyl)cyclopropyl]methyl]-2-cyclopropylacetamide
CID 115456501
N-[[1-(aminomethyl)cyclopentyl]methyl]-2-(oxolan-2-yl)acetamide
CID 113295133
2-cyclopentyl-N-[(3-hydroxypyrrolidin-3-yl)methyl]acetamide
CID 114760691
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2-piperidin-4-ylacetamide;hydrochloride
CID 154911412
3-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]propanamide
CID 119313805
1-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]cyclohexane-1-carboxamide
CID 119313827
2-(4-aminocyclohexyl)-N-[(1-methylcyclopentyl)methyl]acetamide
CID 55260453
N-(3-aminopropyl)-2-cyclopentylacetamide
CID 24706958
[1-(aminomethyl)cyclopropyl]methylcarbamic acid
CID 89477777

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide (CID 115456696) is N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide is NCC1(CNC(=O)CC2CCCC2)CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide?
The InChIKey is QBOBQCPJDODYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c13-8-12(5-6-12)9-14-11(15)7-10-3-1-2-4-10/h10H,1-9,13H2,(H,14,15).
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide?
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide has a molecular weight of 210.32 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-cyclopentylacetamide is sourced from PubChem (CID 115456696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).