(3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine

C19H26N2 — CID 44592157

IUPAC(3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine
SMILESCC(C)CN(Cc1ccc2ccccc2c1)[C@@H]1CCNC1
InChIInChI=1S/C19H26N2/c1-15(2)13-21(19-9-10-20-12-19)14-16-7-8-17-5-3-4-6-18(17)11-16/h3-8,11,15,19-20H,9-10,12-14H2,1-2H3/t19-/m1/s1
InChIKeyOZOVADGYFYTOAE-LJQANCHMSA-N
MW282.43 g/mol
LogP3.66
Rot. Bonds5

About (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine

(3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine (PubChem CID 44592157) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine
PubChem CID44592157
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name(3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine
SMILESCC(C)CN(Cc1ccc2ccccc2c1)[C@@H]1CCNC1
InChIInChI=1S/C19H26N2/c1-15(2)13-21(19-9-10-20-12-19)14-16-7-8-17-5-3-4-6-18(17)11-16/h3-8,11,15,19-20H,9-10,12-14H2,1-2H3/t19-/m1/s1
InChIKeyOZOVADGYFYTOAE-LJQANCHMSA-N
XLogP3.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine?
The IUPAC name of (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine (CID 44592157) is (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine?
The canonical SMILES for (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine is CC(C)CN(Cc1ccc2ccccc2c1)[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine?
The InChIKey is OZOVADGYFYTOAE-LJQANCHMSA-N. The full InChI is InChI=1S/C19H26N2/c1-15(2)13-21(19-9-10-20-12-19)14-16-7-8-17-5-3-4-6-18(17)11-16/h3-8,11,15,19-20H,9-10,12-14H2,1-2H3/t19-/m1/s1.
What are the key properties of (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine?
(3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine has a molecular weight of 282.43 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-methylpropyl)-N-(naphthalen-2-ylmethyl)pyrrolidin-3-amine is sourced from PubChem (CID 44592157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).