(2-phenylcyclopropyl)-quinolin-2-ylmethanamine

C19H18N2 — CID 116517494

IUPAC(2-phenylcyclopropyl)-quinolin-2-ylmethanamine
SMILESNC(c1ccc2ccccc2n1)C1CC1c1ccccc1
InChIInChI=1S/C19H18N2/c20-19(16-12-15(16)13-6-2-1-3-7-13)18-11-10-14-8-4-5-9-17(14)21-18/h1-11,15-16,19H,12,20H2
InChIKeyKRPNLHRPMTWHAK-UHFFFAOYSA-N
MW274.37 g/mol
LogP4.04
Rot. Bonds3

About (2-phenylcyclopropyl)-quinolin-2-ylmethanamine

(2-phenylcyclopropyl)-quinolin-2-ylmethanamine (PubChem CID 116517494) has the molecular formula C19H18N2 and a molecular weight of 274.37 g/mol. Its IUPAC name is (2-phenylcyclopropyl)-quinolin-2-ylmethanamine.

Molecular Properties

Compound Name(2-phenylcyclopropyl)-quinolin-2-ylmethanamine
PubChem CID116517494
Molecular FormulaC19H18N2
Molecular Weight274.37 g/mol
Exact Mass274.15
IUPAC Name(2-phenylcyclopropyl)-quinolin-2-ylmethanamine
SMILESNC(c1ccc2ccccc2n1)C1CC1c1ccccc1
InChIInChI=1S/C19H18N2/c20-19(16-12-15(16)13-6-2-1-3-7-13)18-11-10-14-8-4-5-9-17(14)21-18/h1-11,15-16,19H,12,20H2
InChIKeyKRPNLHRPMTWHAK-UHFFFAOYSA-N
XLogP4.04
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-phenylcyclopropyl)-quinolin-2-ylmethanamine?
The IUPAC name of (2-phenylcyclopropyl)-quinolin-2-ylmethanamine (CID 116517494) is (2-phenylcyclopropyl)-quinolin-2-ylmethanamine.
What is the SMILES notation for (2-phenylcyclopropyl)-quinolin-2-ylmethanamine?
The canonical SMILES for (2-phenylcyclopropyl)-quinolin-2-ylmethanamine is NC(c1ccc2ccccc2n1)C1CC1c1ccccc1.
What is the InChIKey of (2-phenylcyclopropyl)-quinolin-2-ylmethanamine?
The InChIKey is KRPNLHRPMTWHAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2/c20-19(16-12-15(16)13-6-2-1-3-7-13)18-11-10-14-8-4-5-9-17(14)21-18/h1-11,15-16,19H,12,20H2.
What are the key properties of (2-phenylcyclopropyl)-quinolin-2-ylmethanamine?
(2-phenylcyclopropyl)-quinolin-2-ylmethanamine has a molecular weight of 274.37 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylcyclopropyl)-quinolin-2-ylmethanamine is sourced from PubChem (CID 116517494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).