N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine

C18H36N2 — CID 63495742

IUPACN-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
SMILESCCC(CC)CN(CC)CC1(CNC2CC2)CCCC1
InChIInChI=1S/C18H36N2/c1-4-16(5-2)13-20(6-3)15-18(11-7-8-12-18)14-19-17-9-10-17/h16-17,19H,4-15H2,1-3H3
InChIKeyHCYKTWYSJQVDDS-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.06
Rot. Bonds10

About N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine

N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine (PubChem CID 63495742) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
PubChem CID63495742
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC NameN-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
SMILESCCC(CC)CN(CC)CC1(CNC2CC2)CCCC1
InChIInChI=1S/C18H36N2/c1-4-16(5-2)13-20(6-3)15-18(11-7-8-12-18)14-19-17-9-10-17/h16-17,19H,4-15H2,1-3H3
InChIKeyHCYKTWYSJQVDDS-UHFFFAOYSA-N
XLogP4.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[[1-[[bis(2-methylpropyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 63493102
N-[[1-[[butyl(ethyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 63483056
N-[[1-[[cyclobutylmethyl(ethyl)amino]methyl]cycloheptyl]methyl]cyclopropanamine
CID 107401601
N-[[1-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 62256212
N-[[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
CID 62256933
2-N-[[1-[(cyclopropylamino)methyl]cyclohexyl]methyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191382
N-[[1-[[propan-2-yl(propyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
CID 62263309
N-[[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 62260942
N-[[1-[[methyl(pentan-2-yl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 62256313
N-[[1-[[methyl(1-methylsulfanylbutan-2-yl)amino]methyl]cycloheptyl]methyl]cyclopropanamine
CID 115987485
N-[[1-(diethylaminomethyl)cyclohexyl]methyl]propan-2-amine
CID 62262794
N-[[1-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 112664935

Frequently Asked Questions

What is the IUPAC name of N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine (CID 63495742) is N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine is CCC(CC)CN(CC)CC1(CNC2CC2)CCCC1.
What is the InChIKey of N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine?
The InChIKey is HCYKTWYSJQVDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-4-16(5-2)13-20(6-3)15-18(11-7-8-12-18)14-19-17-9-10-17/h16-17,19H,4-15H2,1-3H3.
What are the key properties of N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine?
N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine has a molecular weight of 280.50 g/mol, XLogP of 4.06, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[[ethyl(2-ethylbutyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine is sourced from PubChem (CID 63495742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).