2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine

C14H20N4 — CID 79485465

IUPAC2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine
SMILESCn1cc(CNC(C)(C)C)c(-c2ccccn2)n1
InChIInChI=1S/C14H20N4/c1-14(2,3)16-9-11-10-18(4)17-13(11)12-7-5-6-8-15-12/h5-8,10,16H,9H2,1-4H3
InChIKeyOQPJYHCMECTLRJ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.37
Rot. Bonds3

About 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine

2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine (PubChem CID 79485465) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine
PubChem CID79485465
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine
SMILESCn1cc(CNC(C)(C)C)c(-c2ccccn2)n1
InChIInChI=1S/C14H20N4/c1-14(2,3)16-9-11-10-18(4)17-13(11)12-7-5-6-8-15-12/h5-8,10,16H,9H2,1-4H3
InChIKeyOQPJYHCMECTLRJ-UHFFFAOYSA-N
XLogP2.37
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine (CID 79485465) is 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine is Cn1cc(CNC(C)(C)C)c(-c2ccccn2)n1.
What is the InChIKey of 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine?
The InChIKey is OQPJYHCMECTLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-14(2,3)16-9-11-10-18(4)17-13(11)12-7-5-6-8-15-12/h5-8,10,16H,9H2,1-4H3.
What are the key properties of 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine?
2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine has a molecular weight of 244.34 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-methyl-3-pyridin-2-ylpyrazol-4-yl)methyl]propan-2-amine is sourced from PubChem (CID 79485465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).