(1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine

C13H20N2 — CID 7577779

IUPAC(1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine
SMILESCN[C@@H](CN1CCCC1)c1ccccc1
InChIInChI=1S/C13H20N2/c1-14-13(11-15-9-5-6-10-15)12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3/t13-/m0/s1
InChIKeyZINZYRWMDNKTBY-ZDUSSCGKSA-N
MW204.32 g/mol
LogP2.04
Rot. Bonds4

About (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine

(1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine (PubChem CID 7577779) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine.

Molecular Properties

Compound Name(1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine
PubChem CID7577779
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name(1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine
SMILESCN[C@@H](CN1CCCC1)c1ccccc1
InChIInChI=1S/C13H20N2/c1-14-13(11-15-9-5-6-10-15)12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3/t13-/m0/s1
InChIKeyZINZYRWMDNKTBY-ZDUSSCGKSA-N
XLogP2.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine?
The IUPAC name of (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine (CID 7577779) is (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine.
What is the SMILES notation for (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine?
The canonical SMILES for (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine is CN[C@@H](CN1CCCC1)c1ccccc1.
What is the InChIKey of (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine?
The InChIKey is ZINZYRWMDNKTBY-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H20N2/c1-14-13(11-15-9-5-6-10-15)12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3/t13-/m0/s1.
What are the key properties of (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine?
(1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine has a molecular weight of 204.32 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-methyl-1-phenyl-2-pyrrolidin-1-ylethanamine is sourced from PubChem (CID 7577779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).