1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine

C18H34N2 — CID 63420585

IUPAC1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine
SMILESC1CCN(C2(CNCC3CCCC3)CCCCC2)CC1
InChIInChI=1S/C18H34N2/c1-5-11-18(12-6-1,20-13-7-2-8-14-20)16-19-15-17-9-3-4-10-17/h17,19H,1-16H2
InChIKeyOCWBYMQRVMBBLI-UHFFFAOYSA-N
MW278.48 g/mol
LogP3.95
Rot. Bonds5

About 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine

1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine (PubChem CID 63420585) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine
PubChem CID63420585
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine
SMILESC1CCN(C2(CNCC3CCCC3)CCCCC2)CC1
InChIInChI=1S/C18H34N2/c1-5-11-18(12-6-1,20-13-7-2-8-14-20)16-19-15-17-9-3-4-10-17/h17,19H,1-16H2
InChIKeyOCWBYMQRVMBBLI-UHFFFAOYSA-N
XLogP3.95
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine?
The IUPAC name of 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine (CID 63420585) is 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine.
What is the SMILES notation for 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine?
The canonical SMILES for 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine is C1CCN(C2(CNCC3CCCC3)CCCCC2)CC1.
What is the InChIKey of 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine?
The InChIKey is OCWBYMQRVMBBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-5-11-18(12-6-1,20-13-7-2-8-14-20)16-19-15-17-9-3-4-10-17/h17,19H,1-16H2.
What are the key properties of 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine?
1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine has a molecular weight of 278.48 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]methanamine is sourced from PubChem (CID 63420585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).