1-ethyl-N-(1-phenylbutyl)piperidin-4-amine

C17H28N2 — CID 43224635

IUPAC1-ethyl-N-(1-phenylbutyl)piperidin-4-amine
SMILESCCCC(NC1CCN(CC)CC1)c1ccccc1
InChIInChI=1S/C17H28N2/c1-3-8-17(15-9-6-5-7-10-15)18-16-11-13-19(4-2)14-12-16/h5-7,9-10,16-18H,3-4,8,11-14H2,1-2H3
InChIKeyMKVHPBUSEKMXOB-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.60
Rot. Bonds6

About 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine

1-ethyl-N-(1-phenylbutyl)piperidin-4-amine (PubChem CID 43224635) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-(1-phenylbutyl)piperidin-4-amine
PubChem CID43224635
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name1-ethyl-N-(1-phenylbutyl)piperidin-4-amine
SMILESCCCC(NC1CCN(CC)CC1)c1ccccc1
InChIInChI=1S/C17H28N2/c1-3-8-17(15-9-6-5-7-10-15)18-16-11-13-19(4-2)14-12-16/h5-7,9-10,16-18H,3-4,8,11-14H2,1-2H3
InChIKeyMKVHPBUSEKMXOB-UHFFFAOYSA-N
XLogP3.60
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-phenylbutyl)-1-propan-2-ylpiperidin-4-amine
CID 43182970
1-[4-(1-phenylbutylamino)piperidin-1-yl]ethanone
CID 43224633
N-benzhydryl-1-ethylpiperidin-4-amine
CID 3821522
4-(1-phenylbutylamino)piperidine-1-carboxamide
CID 43785944
N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-phenylbutan-1-amine
CID 43720301
2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid
CID 62110488
N-(1-phenylbutyl)-3-propan-2-ylcyclobutan-1-amine
CID 103561357
1-ethyl-N-[1-(4-fluorophenyl)propyl]piperidin-4-amine
CID 54917034
4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine
CID 43761510
N-(1-phenylpentyl)cycloheptanamine
CID 43767069
1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine
CID 99717003
N-(1-phenylbutyl)-1-azabicyclo[2.2.2]octan-3-amine
CID 43195150

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine?
The IUPAC name of 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine (CID 43224635) is 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine is CCCC(NC1CCN(CC)CC1)c1ccccc1.
What is the InChIKey of 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine?
The InChIKey is MKVHPBUSEKMXOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-3-8-17(15-9-6-5-7-10-15)18-16-11-13-19(4-2)14-12-16/h5-7,9-10,16-18H,3-4,8,11-14H2,1-2H3.
What are the key properties of 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine?
1-ethyl-N-(1-phenylbutyl)piperidin-4-amine has a molecular weight of 260.43 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(1-phenylbutyl)piperidin-4-amine is sourced from PubChem (CID 43224635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).