N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine

C19H31N3 — CID 175562340

IUPACN-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine
SMILESCN1CCC(NN2CCC(C)(C)CC2)CC1c1ccccc1
InChIInChI=1S/C19H31N3/c1-19(2)10-13-22(14-11-19)20-17-9-12-21(3)18(15-17)16-7-5-4-6-8-16/h4-8,17-18,20H,9-15H2,1-3H3
InChIKeyIQKJFLPPPPFICQ-UHFFFAOYSA-N
MW301.48 g/mol
LogP3.45
Rot. Bonds3

About N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine

N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine (PubChem CID 175562340) has the molecular formula C19H31N3 and a molecular weight of 301.48 g/mol. Its IUPAC name is N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine.

Molecular Properties

Compound NameN-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine
PubChem CID175562340
Molecular FormulaC19H31N3
Molecular Weight301.48 g/mol
Exact Mass301.25
IUPAC NameN-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine
SMILESCN1CCC(NN2CCC(C)(C)CC2)CC1c1ccccc1
InChIInChI=1S/C19H31N3/c1-19(2)10-13-22(14-11-19)20-17-9-12-21(3)18(15-17)16-7-5-4-6-8-16/h4-8,17-18,20H,9-15H2,1-3H3
InChIKeyIQKJFLPPPPFICQ-UHFFFAOYSA-N
XLogP3.45
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.48
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-2-phenylazetidine
CID 576373
(2R,4S)-1-methyl-2-phenylpiperidin-4-ol
CID 71409526
(2R,4S)-1-methyl-2-phenyl-4-(trifluoromethoxy)piperidine
CID 149125119
1-methyl-2-phenylazepane
CID 23447707
1-[2-(1-methyl-2-phenylpiperidin-4-yl)ethyl]-4-phenylpiperazine
CID 171355756
1-[[2-(4-bromophenyl)-1-methylpiperidin-4-yl]amino]-N-methylcyclopropane-1-carboxamide
CID 166284441
(2S,4R)-N,1-diethyl-2-phenylpiperidin-4-amine
CID 165141986
1,2-dimethyl-N-(4-phenylcyclohexyl)piperidin-4-amine
CID 81297051
tert-butyl (2S)-4-[(1-methylcyclopropyl)amino]-2-phenylpiperidine-1-carboxylate
CID 165142124
1,4-dimethyl-2-phenylpiperazine;hydroiodide
CID 168921950
1-[[2-(4-bromophenyl)-1-methylpiperidin-4-yl]amino]-N-methylcyclopropane-1-carboxamide;2,2,2-trifluoroacetic acid
CID 166284440
1-[1-(1-methylcyclopropyl)ethenyl]-2-phenylpyrrolidine
CID 129194226

Frequently Asked Questions

What is the IUPAC name of N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine?
The IUPAC name of N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine (CID 175562340) is N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine.
What is the SMILES notation for N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine?
The canonical SMILES for N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine is CN1CCC(NN2CCC(C)(C)CC2)CC1c1ccccc1.
What is the InChIKey of N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine?
The InChIKey is IQKJFLPPPPFICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3/c1-19(2)10-13-22(14-11-19)20-17-9-12-21(3)18(15-17)16-7-5-4-6-8-16/h4-8,17-18,20H,9-15H2,1-3H3.
What are the key properties of N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine?
N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine has a molecular weight of 301.48 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-dimethylpiperidin-1-yl)-1-methyl-2-phenylpiperidin-4-amine is sourced from PubChem (CID 175562340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).