(4,4-diphenylpyrrolidin-2-yl)methanamine

C17H20N2 — CID 101438114

IUPAC(4,4-diphenylpyrrolidin-2-yl)methanamine
SMILESNCC1CC(c2ccccc2)(c2ccccc2)CN1
InChIInChI=1S/C17H20N2/c18-12-16-11-17(13-19-16,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16,19H,11-13,18H2
InChIKeySNAVFWQVAYSSSP-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.29
Rot. Bonds3

About (4,4-diphenylpyrrolidin-2-yl)methanamine

(4,4-diphenylpyrrolidin-2-yl)methanamine (PubChem CID 101438114) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (4,4-diphenylpyrrolidin-2-yl)methanamine.

Molecular Properties

Compound Name(4,4-diphenylpyrrolidin-2-yl)methanamine
PubChem CID101438114
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name(4,4-diphenylpyrrolidin-2-yl)methanamine
SMILESNCC1CC(c2ccccc2)(c2ccccc2)CN1
InChIInChI=1S/C17H20N2/c18-12-16-11-17(13-19-16,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16,19H,11-13,18H2
InChIKeySNAVFWQVAYSSSP-UHFFFAOYSA-N
XLogP2.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-3-phenylpyrrolidin-3-ol;hydrochloride
CID 3051577
(2R,4S)-2,4-dimethyl-4-phenylpyrrolidine
CID 102398914
4-phenyl-2-azabicyclo[2.1.1]hexane
CID 105431272
[(1R)-2-fluoro-1-phenylcyclopropyl]methanamine
CID 126843009
(1,3,3-triphenylcyclobutyl)benzene
CID 101271353
[(1R)-2-cyclopropyl-2-phenylcyclopropyl]methanamine
CID 105442837
[(2S,4R)-4-phenylpyrrolidin-2-yl]methanamine
CID 57365027
2-(3,5-dibenzylpyrrolidin-3-yl)ethanol
CID 174325742
(1,2-diphenylcyclopropyl)methanamine
CID 12684736
[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanamine;hydrochloride
CID 156592430
2-benzyl-4,4-difluoropyrrolidine;hydrochloride
CID 115039893
(2S)-3,3-diphenylpyrrolidine-2-carboxamide
CID 67922087

Frequently Asked Questions

What is the IUPAC name of (4,4-diphenylpyrrolidin-2-yl)methanamine?
The IUPAC name of (4,4-diphenylpyrrolidin-2-yl)methanamine (CID 101438114) is (4,4-diphenylpyrrolidin-2-yl)methanamine.
What is the SMILES notation for (4,4-diphenylpyrrolidin-2-yl)methanamine?
The canonical SMILES for (4,4-diphenylpyrrolidin-2-yl)methanamine is NCC1CC(c2ccccc2)(c2ccccc2)CN1.
What is the InChIKey of (4,4-diphenylpyrrolidin-2-yl)methanamine?
The InChIKey is SNAVFWQVAYSSSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c18-12-16-11-17(13-19-16,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16,19H,11-13,18H2.
What are the key properties of (4,4-diphenylpyrrolidin-2-yl)methanamine?
(4,4-diphenylpyrrolidin-2-yl)methanamine has a molecular weight of 252.36 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-diphenylpyrrolidin-2-yl)methanamine is sourced from PubChem (CID 101438114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).