N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine

C22H30N2 — CID 58624386

IUPACN-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine
SMILESCC(C)CN(Cc1ccccc1-c1ccccc1)C1CCNCC1
InChIInChI=1S/C22H30N2/c1-18(2)16-24(21-12-14-23-15-13-21)17-20-10-6-7-11-22(20)19-8-4-3-5-9-19/h3-11,18,21,23H,12-17H2,1-2H3
InChIKeyOYYHWRADAIZETA-UHFFFAOYSA-N
MW322.50 g/mol
LogP4.56
Rot. Bonds6

About N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine

N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine (PubChem CID 58624386) has the molecular formula C22H30N2 and a molecular weight of 322.50 g/mol. Its IUPAC name is N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine
PubChem CID58624386
Molecular FormulaC22H30N2
Molecular Weight322.50 g/mol
Exact Mass322.24
IUPAC NameN-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine
SMILESCC(C)CN(Cc1ccccc1-c1ccccc1)C1CCNCC1
InChIInChI=1S/C22H30N2/c1-18(2)16-24(21-12-14-23-15-13-21)17-20-10-6-7-11-22(20)19-8-4-3-5-9-19/h3-11,18,21,23H,12-17H2,1-2H3
InChIKeyOYYHWRADAIZETA-UHFFFAOYSA-N
XLogP4.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.50
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylpropyl)-N-[(3-phenylphenyl)methyl]piperidin-4-amine
CID 58624394
N-(2-methylpropyl)-N-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine
CID 69062877
(E)-but-2-enedioic acid;N-(2-methylpropyl)-N-(quinolin-4-ylmethyl)piperidin-4-amine
CID 68575205
N-[(2-phenylphenyl)methyl]-N-[(3S)-pyrrolidin-3-yl]propanamide
CID 11536862
N-(2-methylpropyl)-N-[(2,3,6-trichlorophenyl)methyl]piperidin-4-amine
CID 58624363
1,1-dimethyl-3-[(2-phenylphenyl)methyl]-3-[(3S)-pyrrolidin-3-yl]urea
CID 44578375
but-2-enedioic acid;(3S)-N-[(2-ethoxyphenyl)methyl]-N-(2-methylpropyl)pyrrolidin-3-amine
CID 69062038
N-(2-methylpropyl)-N-(1,2,3,4-tetrahydroisoquinolin-5-ylmethyl)cyclopentanamine
CID 104557605
but-2-enedioic acid;(3S)-N-(2-methylpropyl)-N-[(2-phenoxyphenyl)methyl]pyrrolidin-3-amine
CID 69059391
(3S)-N-[(2,3-dichlorophenyl)methyl]-N-(2-methylpropyl)pyrrolidin-3-amine;(2R,3R)-2,3-dihydroxybutanedioic acid
CID 69063709
N-[(2-phenylphenyl)methyl]-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-1-carboxamide
CID 44578265
(3R)-N-[(2-chloro-3-methylphenyl)methyl]-N-(2-methylpropyl)pyrrolidin-3-amine;2,3-dihydroxybutanedioic acid
CID 69063680

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine?
The IUPAC name of N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine (CID 58624386) is N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine.
What is the SMILES notation for N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine?
The canonical SMILES for N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine is CC(C)CN(Cc1ccccc1-c1ccccc1)C1CCNCC1.
What is the InChIKey of N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine?
The InChIKey is OYYHWRADAIZETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2/c1-18(2)16-24(21-12-14-23-15-13-21)17-20-10-6-7-11-22(20)19-8-4-3-5-9-19/h3-11,18,21,23H,12-17H2,1-2H3.
What are the key properties of N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine?
N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine has a molecular weight of 322.50 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-N-[(2-phenylphenyl)methyl]piperidin-4-amine is sourced from PubChem (CID 58624386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).