1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine

C16H32N2 — CID 83995937

IUPAC1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine
SMILESCC(C)CCNC1CCCN(C2CCCCC2)C1
InChIInChI=1S/C16H32N2/c1-14(2)10-11-17-15-7-6-12-18(13-15)16-8-4-3-5-9-16/h14-17H,3-13H2,1-2H3
InChIKeyAZUXPBWZHNMTFF-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds5

About 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine

1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine (PubChem CID 83995937) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine
PubChem CID83995937
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine
SMILESCC(C)CCNC1CCCN(C2CCCCC2)C1
InChIInChI=1S/C16H32N2/c1-14(2)10-11-17-15-7-6-12-18(13-15)16-8-4-3-5-9-16/h14-17H,3-13H2,1-2H3
InChIKeyAZUXPBWZHNMTFF-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
The IUPAC name of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine (CID 83995937) is 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine.
What is the SMILES notation for 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
The canonical SMILES for 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine is CC(C)CCNC1CCCN(C2CCCCC2)C1.
What is the InChIKey of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
The InChIKey is AZUXPBWZHNMTFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-14(2)10-11-17-15-7-6-12-18(13-15)16-8-4-3-5-9-16/h14-17H,3-13H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine?
1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(3-methylbutyl)piperidin-3-amine is sourced from PubChem (CID 83995937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).