N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine

C15H29N — CID 63507298

IUPACN-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CC2CCCC2)CCCCC1
InChIInChI=1S/C15H29N/c1-2-16-13-15(10-6-3-7-11-15)12-14-8-4-5-9-14/h14,16H,2-13H2,1H3
InChIKeyGMZUDSXUBISGDB-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.13
Rot. Bonds5

About N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine

N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine (PubChem CID 63507298) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine
PubChem CID63507298
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CC2CCCC2)CCCCC1
InChIInChI=1S/C15H29N/c1-2-16-13-15(10-6-3-7-11-15)12-14-8-4-5-9-14/h14,16H,2-13H2,1H3
InChIKeyGMZUDSXUBISGDB-UHFFFAOYSA-N
XLogP4.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine?
The IUPAC name of N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine (CID 63507298) is N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine?
The canonical SMILES for N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine is CCNCC1(CC2CCCC2)CCCCC1.
What is the InChIKey of N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine?
The InChIKey is GMZUDSXUBISGDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-2-16-13-15(10-6-3-7-11-15)12-14-8-4-5-9-14/h14,16H,2-13H2,1H3.
What are the key properties of N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine?
N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine has a molecular weight of 223.40 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(cyclopentylmethyl)cyclohexyl]methyl]ethanamine is sourced from PubChem (CID 63507298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).