N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine

C15H17N5 — CID 141210003

IUPACN-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine
SMILESCNCc1ccc(N2CC(c3cccnc3)=CN2)nc1
InChIInChI=1S/C15H17N5/c1-16-7-12-4-5-15(18-8-12)20-11-14(10-19-20)13-3-2-6-17-9-13/h2-6,8-10,16,19H,7,11H2,1H3
InChIKeyVCRJFJICTYNXRJ-UHFFFAOYSA-N
MW267.34 g/mol
LogP1.56
Rot. Bonds4

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

N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine (PubChem CID 141210003) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine
PubChem CID141210003
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC NameN-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine
SMILESCNCc1ccc(N2CC(c3cccnc3)=CN2)nc1
InChIInChI=1S/C15H17N5/c1-16-7-12-4-5-15(18-8-12)20-11-14(10-19-20)13-3-2-6-17-9-13/h2-6,8-10,16,19H,7,11H2,1H3
InChIKeyVCRJFJICTYNXRJ-UHFFFAOYSA-N
XLogP1.56
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine (CID 141210003) is N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine is CNCc1ccc(N2CC(c3cccnc3)=CN2)nc1.
What is the InChIKey of N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine?
The InChIKey is VCRJFJICTYNXRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-16-7-12-4-5-15(18-8-12)20-11-14(10-19-20)13-3-2-6-17-9-13/h2-6,8-10,16,19H,7,11H2,1H3.
What are the key properties of N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine?
N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine has a molecular weight of 267.34 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-(4-pyridin-3-yl-1,3-dihydropyrazol-2-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 141210003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).