[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine

C14H20N4 — CID 62488465

IUPAC[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine
SMILESCc1cc(C)c(CN)c(-n2ccc(C(C)C)n2)n1
InChIInChI=1S/C14H20N4/c1-9(2)13-5-6-18(17-13)14-12(8-15)10(3)7-11(4)16-14/h5-7,9H,8,15H2,1-4H3
InChIKeyROHBSCPXZOAJHN-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.47
Rot. Bonds3

About [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine

[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine (PubChem CID 62488465) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine
PubChem CID62488465
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine
SMILESCc1cc(C)c(CN)c(-n2ccc(C(C)C)n2)n1
InChIInChI=1S/C14H20N4/c1-9(2)13-5-6-18(17-13)14-12(8-15)10(3)7-11(4)16-14/h5-7,9H,8,15H2,1-4H3
InChIKeyROHBSCPXZOAJHN-UHFFFAOYSA-N
XLogP2.47
TPSA56.73 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 ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-methyl-6-(3-propan-2-ylpyrazol-1-yl)-4-pyridinyl]methanamine
CID 113379458
N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62490045
3-(chloromethyl)-4,6-dimethyl-2-(3-methylpyrazol-1-yl)pyridine
CID 62490039
[2-(3-propan-2-ylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine
CID 62488466
[2-fluoro-6-(3-propan-2-ylpyrazol-1-yl)phenyl]methanamine
CID 79515347
5-methyl-6-(3-propan-2-ylpyrazol-1-yl)pyridine-3-carbaldehyde
CID 80632719
[2-(4-butan-2-ylpiperazin-1-yl)-4,6-dimethyl-3-pyridinyl]methanamine
CID 62773611
2-methyl-6-(3-propan-2-ylpyrazol-1-yl)pyrimidin-4-amine
CID 80857482
5-amino-6-(3-propan-2-ylpyrazol-1-yl)pyridine-2-carboxylic acid
CID 114408260
[4,6-dimethyl-2-(4-methylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 61175547
4-chloro-5-methyl-2-propan-2-yl-6-(3-propan-2-ylpyrazol-1-yl)pyrimidine
CID 80978002
5-methyl-2-(3-propan-2-ylpyrazol-1-yl)pyridin-4-amine
CID 83265766

Frequently Asked Questions

What is the IUPAC name of [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine?
The IUPAC name of [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine (CID 62488465) is [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine is Cc1cc(C)c(CN)c(-n2ccc(C(C)C)n2)n1.
What is the InChIKey of [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine?
The InChIKey is ROHBSCPXZOAJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-9(2)13-5-6-18(17-13)14-12(8-15)10(3)7-11(4)16-14/h5-7,9H,8,15H2,1-4H3.
What are the key properties of [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine?
[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine has a molecular weight of 244.34 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 62488465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).