(3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine

C16H18N2 — CID 80521414

IUPAC(3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine
SMILESNCC1(c2ccccn2)CC(c2ccccc2)C1
InChIInChI=1S/C16H18N2/c17-12-16(15-8-4-5-9-18-15)10-14(11-16)13-6-2-1-3-7-13/h1-9,14H,10-12,17H2
InChIKeyUGNHYCZXUMDDQE-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.86
Rot. Bonds3

About (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine

(3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine (PubChem CID 80521414) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine.

Molecular Properties

Compound Name(3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine
PubChem CID80521414
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name(3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine
SMILESNCC1(c2ccccn2)CC(c2ccccc2)C1
InChIInChI=1S/C16H18N2/c17-12-16(15-8-4-5-9-18-15)10-14(11-16)13-6-2-1-3-7-13/h1-9,14H,10-12,17H2
InChIKeyUGNHYCZXUMDDQE-UHFFFAOYSA-N
XLogP2.86
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine?
The IUPAC name of (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine (CID 80521414) is (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine.
What is the SMILES notation for (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine?
The canonical SMILES for (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine is NCC1(c2ccccn2)CC(c2ccccc2)C1.
What is the InChIKey of (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine?
The InChIKey is UGNHYCZXUMDDQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c17-12-16(15-8-4-5-9-18-15)10-14(11-16)13-6-2-1-3-7-13/h1-9,14H,10-12,17H2.
What are the key properties of (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine?
(3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine has a molecular weight of 238.33 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenyl-1-pyridin-2-ylcyclobutyl)methanamine is sourced from PubChem (CID 80521414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).