1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine

C15H25N3 — CID 43617126

IUPAC1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2ccc(N(C)C)cc2)CC1
InChIInChI=1S/C15H25N3/c1-4-16-13-9-11-18(12-10-13)15-7-5-14(6-8-15)17(2)3/h5-8,13,16H,4,9-12H2,1-3H3
InChIKeyPWCUFQVUMRNBBC-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.33
Rot. Bonds4

About 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine

1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine (PubChem CID 43617126) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine
PubChem CID43617126
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2ccc(N(C)C)cc2)CC1
InChIInChI=1S/C15H25N3/c1-4-16-13-9-11-18(12-10-13)15-7-5-14(6-8-15)17(2)3/h5-8,13,16H,4,9-12H2,1-3H3
InChIKeyPWCUFQVUMRNBBC-UHFFFAOYSA-N
XLogP2.33
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-1-[4-(methoxymethyl)phenyl]piperidin-4-amine
CID 114253160
N-ethyl-1-(4-propan-2-yloxyphenyl)piperidin-4-amine
CID 43315540
1-(3,5-difluorophenyl)-N-ethylpiperidin-4-amine
CID 43315453
N,N-dimethyl-4-morpholin-4-ylaniline
CID 11264229
N-[1-[4-(dimethylamino)phenyl]piperidin-4-yl]-3-hydroxypiperidine-1-carboxamide
CID 111508241
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
CID 110745886
N,N-dimethyl-4-piperazin-1-ylaniline
CID 4738754
N-ethyl-1-(5-methyl-3-pyridinyl)piperidin-4-amine
CID 107585707
1-[4-(dimethylamino)phenyl]-N,3-dimethylpiperidin-4-amine
CID 54975690
1-(2-bromophenyl)-N-ethylpiperidin-4-amine
CID 60862139
N'-ethyl-N'-methyl-N-(1-pyridin-4-ylpiperidin-4-yl)ethane-1,2-diamine
CID 55097459
N-ethyl-1-(2-fluorophenyl)piperidin-4-amine
CID 43315313

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine?
The IUPAC name of 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine (CID 43617126) is 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine.
What is the SMILES notation for 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine?
The canonical SMILES for 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine is CCNC1CCN(c2ccc(N(C)C)cc2)CC1.
What is the InChIKey of 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine?
The InChIKey is PWCUFQVUMRNBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-16-13-9-11-18(12-10-13)15-7-5-14(6-8-15)17(2)3/h5-8,13,16H,4,9-12H2,1-3H3.
What are the key properties of 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine?
1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)phenyl]-N-ethylpiperidin-4-amine is sourced from PubChem (CID 43617126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).