1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine

C14H28N2 — CID 115895087

IUPAC1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine
SMILESCC(NCC1CCCCN1C(C)C)C1CC1
InChIInChI=1S/C14H28N2/c1-11(2)16-9-5-4-6-14(16)10-15-12(3)13-7-8-13/h11-15H,4-10H2,1-3H3
InChIKeyZJFVYEQSKKWCQZ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds5

About 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine

1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine (PubChem CID 115895087) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine
PubChem CID115895087
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine
SMILESCC(NCC1CCCCN1C(C)C)C1CC1
InChIInChI=1S/C14H28N2/c1-11(2)16-9-5-4-6-14(16)10-15-12(3)13-7-8-13/h11-15H,4-10H2,1-3H3
InChIKeyZJFVYEQSKKWCQZ-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine (CID 115895087) is 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine is CC(NCC1CCCCN1C(C)C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine?
The InChIKey is ZJFVYEQSKKWCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11(2)16-9-5-4-6-14(16)10-15-12(3)13-7-8-13/h11-15H,4-10H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine?
1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]ethanamine is sourced from PubChem (CID 115895087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).