N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine

C15H32N2 — CID 114004229

IUPACN-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine
SMILESCCCCC(CC)CNCC1CCCC1CN
InChIInChI=1S/C15H32N2/c1-3-5-7-13(4-2)11-17-12-15-9-6-8-14(15)10-16/h13-15,17H,3-12,16H2,1-2H3
InChIKeyCTKOHSKEYWQHIA-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.17
Rot. Bonds9

About N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine

N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine (PubChem CID 114004229) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine.

Molecular Properties

Compound NameN-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine
PubChem CID114004229
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine
SMILESCCCCC(CC)CNCC1CCCC1CN
InChIInChI=1S/C15H32N2/c1-3-5-7-13(4-2)11-17-12-15-9-6-8-14(15)10-16/h13-15,17H,3-12,16H2,1-2H3
InChIKeyCTKOHSKEYWQHIA-UHFFFAOYSA-N
XLogP3.17
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(chloromethyl)cyclopentyl]methyl]-2-ethylbutan-1-amine
CID 82924798
N-[(4-chlorocyclohexyl)methyl]-2-ethylhexan-1-amine
CID 106123390
2-ethyl-N-(piperidin-2-ylmethyl)hexan-1-amine
CID 106632956
N-[[2-(2-ethylhexyl)cyclobutyl]methyl]ethanamine
CID 81018447
N-[(2-chlorocyclopentyl)methyl]-2-ethylbutan-1-amine
CID 82924681
N-[2-(aminomethyl)cyclopentyl]-3-ethylheptanamide;hydrochloride
CID 119602350
N-[[2-(2-ethylhexyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81024041
magnesium;2-ethyl-N-(2-ethylhexyl)hexan-1-amine;dichloride
CID 174776336
N,2-diethylhexan-1-amine
CID 14272988
N-butyl-2-ethylpentane-1,5-diamine
CID 174821174
octakis(dihydroxy(dioxo)molybdenum);2-ethyl-N-(2-ethylhexyl)hexan-1-amine
CID 173007117
N-(2-ethylhexyl)cyclopropanamine
CID 43163806

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine?
The IUPAC name of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine (CID 114004229) is N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine.
What is the SMILES notation for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine?
The canonical SMILES for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine is CCCCC(CC)CNCC1CCCC1CN.
What is the InChIKey of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine?
The InChIKey is CTKOHSKEYWQHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-3-5-7-13(4-2)11-17-12-15-9-6-8-14(15)10-16/h13-15,17H,3-12,16H2,1-2H3.
What are the key properties of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine?
N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine has a molecular weight of 240.43 g/mol, XLogP of 3.17, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethylhexan-1-amine is sourced from PubChem (CID 114004229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).