(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine

C18H22N2 — CID 102977250

IUPAC(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C18H22N2/c19-18-7-4-12-20(14-18)13-15-8-10-17(11-9-15)16-5-2-1-3-6-16/h1-3,5-6,8-11,18H,4,7,12-14,19H2/t18-/m1/s1
InChIKeyFFNWIXUVLHPYKU-GOSISDBHSA-N
MW266.39 g/mol
LogP3.28
Rot. Bonds3

About (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine

(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine (PubChem CID 102977250) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine
PubChem CID102977250
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C18H22N2/c19-18-7-4-12-20(14-18)13-15-8-10-17(11-9-15)16-5-2-1-3-6-16/h1-3,5-6,8-11,18H,4,7,12-14,19H2/t18-/m1/s1
InChIKeyFFNWIXUVLHPYKU-GOSISDBHSA-N
XLogP3.28
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine
CID 62068870
N-methyl-1-[(4-phenylphenyl)methyl]piperidin-3-amine
CID 62535196
4-[[(3S)-3-aminopiperidin-1-yl]methyl]benzonitrile
CID 24904949
1-methyl-4-[[1-[(4-phenylphenyl)methyl]piperidin-3-yl]methyl]piperazine
CID 77081012
4-[(3-aminopiperidin-1-yl)methyl]benzamide
CID 61295537
1-[(4-nitrophenyl)methyl]piperidin-3-amine;hydrochloride
CID 119910124
1-(1-benzylpyrrolidin-3-yl)piperidin-3-amine
CID 61296822
2-[[(3R)-3-aminopiperidin-1-yl]methyl]phenol
CID 24904442
1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-amine
CID 59681853
(3R)-1-[[4-(difluoromethoxy)phenyl]methyl]piperidin-3-amine;hydrochloride
CID 167713987
(3R)-1-[(3-chloro-4-fluorophenyl)methyl]piperidin-3-amine
CID 24904788
(3S)-1-[(3-methylphenyl)methyl]piperidin-3-amine
CID 24904607

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine?
The IUPAC name of (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine (CID 102977250) is (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine.
What is the SMILES notation for (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine?
The canonical SMILES for (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine is N[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1.
What is the InChIKey of (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine?
The InChIKey is FFNWIXUVLHPYKU-GOSISDBHSA-N. The full InChI is InChI=1S/C18H22N2/c19-18-7-4-12-20(14-18)13-15-8-10-17(11-9-15)16-5-2-1-3-6-16/h1-3,5-6,8-11,18H,4,7,12-14,19H2/t18-/m1/s1.
What are the key properties of (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine?
(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine has a molecular weight of 266.39 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine is sourced from PubChem (CID 102977250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).