[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine

C19H24N2 — CID 16793650

IUPAC[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine
SMILESNCc1ccccc1-c1ccc(CN2CCCCC2)cc1
InChIInChI=1S/C19H24N2/c20-14-18-6-2-3-7-19(18)17-10-8-16(9-11-17)15-21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-15,20H2
InChIKeyAWZIQESSHIPBAF-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.80
Rot. Bonds4

About [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine

[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine (PubChem CID 16793650) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine.

Molecular Properties

Compound Name[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine
PubChem CID16793650
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine
SMILESNCc1ccccc1-c1ccc(CN2CCCCC2)cc1
InChIInChI=1S/C19H24N2/c20-14-18-6-2-3-7-19(18)17-10-8-16(9-11-17)15-21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-15,20H2
InChIKeyAWZIQESSHIPBAF-UHFFFAOYSA-N
XLogP3.80
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]phenyl]methanamine
CID 16774933
1-benzylazepane
CID 10954328
1-[(4-bromophenyl)methyl]piperidine;phenylmethanamine
CID 174819017
[4-[(2S,4R,6S)-2-[4-[2-(aminomethyl)phenyl]phenyl]-6-(piperidin-1-ylmethyl)-1,3-dioxan-4-yl]phenyl]methanol
CID 6693299
2-[4-[[4-(2-chlorophenyl)phenyl]methyl]piperazin-1-yl]ethanol
CID 18798287
4-[[2-[4-[[3-(2-fluoroethyl)imidazolidin-1-yl]methyl]phenyl]phenyl]methyl]morpholine
CID 91325196
4-(azacyclododec-1-ylmethyl)aniline
CID 70405299
1-[(4-methylphenyl)methyl]azepane
CID 3951815
[2-(4-cyclohexylphenyl)phenyl]methanamine
CID 63423765
[2-methyl-5-(piperidin-1-ylmethyl)phenyl]methanamine
CID 125454284
[4-[2-[4-[2-(aminomethyl)phenyl]phenyl]-5-methyl-6-(piperidin-1-ylmethyl)-1,3-dioxan-4-yl]phenyl]methanol
CID 5045744
2-methyl-N-[2-oxo-2-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methylamino]ethyl]butanamide
CID 55940350

Frequently Asked Questions

What is the IUPAC name of [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine?
The IUPAC name of [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine (CID 16793650) is [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine.
What is the SMILES notation for [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine?
The canonical SMILES for [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine is NCc1ccccc1-c1ccc(CN2CCCCC2)cc1.
What is the InChIKey of [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine?
The InChIKey is AWZIQESSHIPBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c20-14-18-6-2-3-7-19(18)17-10-8-16(9-11-17)15-21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-15,20H2.
What are the key properties of [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine?
[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine has a molecular weight of 280.42 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine is sourced from PubChem (CID 16793650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).