4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine

C14H20N2 — CID 165468446

IUPAC4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine
SMILESCC1(N)CNCC1c1cccc(C2CC2)c1
InChIInChI=1S/C14H20N2/c1-14(15)9-16-8-13(14)12-4-2-3-11(7-12)10-5-6-10/h2-4,7,10,13,16H,5-6,8-9,15H2,1H3
InChIKeyYTIANQNGSSCAPK-UHFFFAOYSA-N
MW216.33 g/mol
LogP1.97
Rot. Bonds2

About 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine

4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine (PubChem CID 165468446) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine
PubChem CID165468446
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine
SMILESCC1(N)CNCC1c1cccc(C2CC2)c1
InChIInChI=1S/C14H20N2/c1-14(15)9-16-8-13(14)12-4-2-3-11(7-12)10-5-6-10/h2-4,7,10,13,16H,5-6,8-9,15H2,1H3
InChIKeyYTIANQNGSSCAPK-UHFFFAOYSA-N
XLogP1.97
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine?
The IUPAC name of 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine (CID 165468446) is 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine.
What is the SMILES notation for 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine?
The canonical SMILES for 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine is CC1(N)CNCC1c1cccc(C2CC2)c1.
What is the InChIKey of 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine?
The InChIKey is YTIANQNGSSCAPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-14(15)9-16-8-13(14)12-4-2-3-11(7-12)10-5-6-10/h2-4,7,10,13,16H,5-6,8-9,15H2,1H3.
What are the key properties of 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine?
4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine has a molecular weight of 216.33 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopropylphenyl)-3-methylpyrrolidin-3-amine is sourced from PubChem (CID 165468446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).