1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine

C14H28N2 — CID 115704112

IUPAC1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine
SMILESCCCC(C)NC1CCN(CC2CC2)CC1
InChIInChI=1S/C14H28N2/c1-3-4-12(2)15-14-7-9-16(10-8-14)11-13-5-6-13/h12-15H,3-11H2,1-2H3
InChIKeyGUZHRFTVLXKDGQ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds6

About 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine

1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine (PubChem CID 115704112) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine
PubChem CID115704112
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine
SMILESCCCC(C)NC1CCN(CC2CC2)CC1
InChIInChI=1S/C14H28N2/c1-3-4-12(2)15-14-7-9-16(10-8-14)11-13-5-6-13/h12-15H,3-11H2,1-2H3
InChIKeyGUZHRFTVLXKDGQ-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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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Related Compounds

N,N-Dimethylpiperidin-4-amine
CID 417391
1-(2-Methylpropyl)piperidin-4-amine
CID 550780
1-Methyl-4-(methylamino)piperidine
CID 566323
1-Ethylpiperidin-4-amine
CID 3734990
1-(1-Isopropyl-3-piperidinyl)methanamine
CID 3157476
1-(Propan-2-yl)piperidin-4-amine
CID 3163333
N,N-diethylpiperidin-4-amine
CID 2758239
N-(Propan-2-yl)piperidin-4-amine
CID 22394351
N,N-dipropylpiperidin-4-amine
CID 3824021
1,3-Dimethylpiperidin-4-amine
CID 23008883
2-[1-(2-Methylpropyl)piperidin-2-yl]ethan-1-amine
CID 45791072
1-Butylpiperidin-4-amine
CID 12262820

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine?
The IUPAC name of 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine (CID 115704112) is 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine.
What is the SMILES notation for 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine?
The canonical SMILES for 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine is CCCC(C)NC1CCN(CC2CC2)CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine?
The InChIKey is GUZHRFTVLXKDGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-4-12(2)15-14-7-9-16(10-8-14)11-13-5-6-13/h12-15H,3-11H2,1-2H3.
What are the key properties of 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine?
1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine is sourced from PubChem (CID 115704112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).