N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine

C16H24N2 — CID 131227693

IUPACN-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine
SMILESCC1CCC(N(Cc2ccccc2)C2CC2)CN1
InChIInChI=1S/C16H24N2/c1-13-7-8-16(11-17-13)18(15-9-10-15)12-14-5-3-2-4-6-14/h2-6,13,15-17H,7-12H2,1H3
InChIKeyOZOMPBMNJLEGRK-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.79
Rot. Bonds4

About N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine

N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine (PubChem CID 131227693) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine
PubChem CID131227693
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine
SMILESCC1CCC(N(Cc2ccccc2)C2CC2)CN1
InChIInChI=1S/C16H24N2/c1-13-7-8-16(11-17-13)18(15-9-10-15)12-14-5-3-2-4-6-14/h2-6,13,15-17H,7-12H2,1H3
InChIKeyOZOMPBMNJLEGRK-UHFFFAOYSA-N
XLogP2.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine?
The IUPAC name of N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine (CID 131227693) is N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine.
What is the SMILES notation for N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine?
The canonical SMILES for N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine is CC1CCC(N(Cc2ccccc2)C2CC2)CN1.
What is the InChIKey of N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine?
The InChIKey is OZOMPBMNJLEGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-13-7-8-16(11-17-13)18(15-9-10-15)12-14-5-3-2-4-6-14/h2-6,13,15-17H,7-12H2,1H3.
What are the key properties of N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine?
N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine has a molecular weight of 244.38 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-6-methylpiperidin-3-amine is sourced from PubChem (CID 131227693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).