1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine

C17H20N2 — CID 62068870

IUPAC1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine
SMILESNC1CCN(Cc2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C17H20N2/c18-17-10-11-19(13-17)12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17H,10-13,18H2
InChIKeyNZVSWPFFBLBRJP-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.89
Rot. Bonds3

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

1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine (PubChem CID 62068870) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine
PubChem CID62068870
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine
SMILESNC1CCN(Cc2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C17H20N2/c18-17-10-11-19(13-17)12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17H,10-13,18H2
InChIKeyNZVSWPFFBLBRJP-UHFFFAOYSA-N
XLogP2.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine
CID 102977250
1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-amine
CID 59681853
(3R)-1-[(4-bromophenyl)methyl]pyrrolidin-3-amine
CID 53256327
1-[(4-bromophenyl)methyl]pyrrolidin-3-amine;dihydrochloride
CID 75994008
1-[(4-fluorophenyl)methyl]pyrrolidin-3-amine;dihydrochloride
CID 53422149
(3R)-1-[(4-ethylphenyl)methyl]pyrrolidin-3-amine;hydrochloride
CID 119905330
(3S)-1-(pyridin-4-ylmethyl)pyrrolidin-3-amine
CID 39225703
1-[(3,4-dichlorophenyl)methyl]pyrrolidin-3-amine
CID 11382802
(3R)-1-[[4-(dimethylamino)phenyl]methyl]pyrrolidin-3-amine
CID 94339766
(3S)-1-[(4-ethoxyphenyl)methyl]pyrrolidin-3-amine
CID 94339773
(3R)-1-[(4-ethoxyphenyl)methyl]pyrrolidin-3-amine
CID 68965269
1-[[4-(diethylamino)phenyl]methyl]pyrrolidin-3-amine
CID 102550610

Frequently Asked Questions

What is the IUPAC name of 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine?
The IUPAC name of 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine (CID 62068870) is 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine.
What is the SMILES notation for 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine?
The canonical SMILES for 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine is NC1CCN(Cc2ccc(-c3ccccc3)cc2)C1.
What is the InChIKey of 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine?
The InChIKey is NZVSWPFFBLBRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c18-17-10-11-19(13-17)12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17H,10-13,18H2.
What are the key properties of 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine?
1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine has a molecular weight of 252.36 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine is sourced from PubChem (CID 62068870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).