1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine

C19H24N2 — CID 43829706

IUPAC1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine
SMILESCC(N)(c1ccccc1)C(c1ccccc1)N1CCCC1
InChIInChI=1S/C19H24N2/c1-19(20,17-12-6-3-7-13-17)18(21-14-8-9-15-21)16-10-4-2-5-11-16/h2-7,10-13,18H,8-9,14-15,20H2,1H3
InChIKeyHHZDOCGJTIVLPX-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.70
Rot. Bonds4

About 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine

1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine (PubChem CID 43829706) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine.

Molecular Properties

Compound Name1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine
PubChem CID43829706
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine
SMILESCC(N)(c1ccccc1)C(c1ccccc1)N1CCCC1
InChIInChI=1S/C19H24N2/c1-19(20,17-12-6-3-7-13-17)18(21-14-8-9-15-21)16-10-4-2-5-11-16/h2-7,10-13,18H,8-9,14-15,20H2,1H3
InChIKeyHHZDOCGJTIVLPX-UHFFFAOYSA-N
XLogP3.70
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 ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine?
The IUPAC name of 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine (CID 43829706) is 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine.
What is the SMILES notation for 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine?
The canonical SMILES for 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine is CC(N)(c1ccccc1)C(c1ccccc1)N1CCCC1.
What is the InChIKey of 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine?
The InChIKey is HHZDOCGJTIVLPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-19(20,17-12-6-3-7-13-17)18(21-14-8-9-15-21)16-10-4-2-5-11-16/h2-7,10-13,18H,8-9,14-15,20H2,1H3.
What are the key properties of 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine?
1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine has a molecular weight of 280.42 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine is sourced from PubChem (CID 43829706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).