N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine

C17H34N2 — CID 62615159

IUPACN-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine
SMILESCCCNC1CCCC1CN(CC)C1CCCCC1
InChIInChI=1S/C17H34N2/c1-3-13-18-17-12-8-9-15(17)14-19(4-2)16-10-6-5-7-11-16/h15-18H,3-14H2,1-2H3
InChIKeyOMVMMXXQHPSLEZ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.81
Rot. Bonds7

About N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine

N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine (PubChem CID 62615159) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine.

Molecular Properties

Compound NameN-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine
PubChem CID62615159
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine
SMILESCCCNC1CCCC1CN(CC)C1CCCCC1
InChIInChI=1S/C17H34N2/c1-3-13-18-17-12-8-9-15(17)14-19(4-2)16-10-6-5-7-11-16/h15-18H,3-14H2,1-2H3
InChIKeyOMVMMXXQHPSLEZ-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine?
The IUPAC name of N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine (CID 62615159) is N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine.
What is the SMILES notation for N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine?
The canonical SMILES for N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine is CCCNC1CCCC1CN(CC)C1CCCCC1.
What is the InChIKey of N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine?
The InChIKey is OMVMMXXQHPSLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-3-13-18-17-12-8-9-15(17)14-19(4-2)16-10-6-5-7-11-16/h15-18H,3-14H2,1-2H3.
What are the key properties of N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine?
N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine has a molecular weight of 266.47 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine is sourced from PubChem (CID 62615159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).