[2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine

C16H20N4 — CID 114765140

IUPAC[2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine
SMILESCc1cc(CN)cc(N2CCCC2c2cccnc2)n1
InChIInChI=1S/C16H20N4/c1-12-8-13(10-17)9-16(19-12)20-7-3-5-15(20)14-4-2-6-18-11-14/h2,4,6,8-9,11,15H,3,5,7,10,17H2,1H3
InChIKeyVJOBJAMVRKRKRF-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.59
Rot. Bonds3

About [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine

[2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine (PubChem CID 114765140) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine
PubChem CID114765140
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name[2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine
SMILESCc1cc(CN)cc(N2CCCC2c2cccnc2)n1
InChIInChI=1S/C16H20N4/c1-12-8-13(10-17)9-16(19-12)20-7-3-5-15(20)14-4-2-6-18-11-14/h2,4,6,8-9,11,15H,3,5,7,10,17H2,1H3
InChIKeyVJOBJAMVRKRKRF-UHFFFAOYSA-N
XLogP2.59
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
The IUPAC name of [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine (CID 114765140) is [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine is Cc1cc(CN)cc(N2CCCC2c2cccnc2)n1.
What is the InChIKey of [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
The InChIKey is VJOBJAMVRKRKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-12-8-13(10-17)9-16(19-12)20-7-3-5-15(20)14-4-2-6-18-11-14/h2,4,6,8-9,11,15H,3,5,7,10,17H2,1H3.
What are the key properties of [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
[2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine has a molecular weight of 268.36 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-6-(2-pyridin-3-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 114765140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).