N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine

C15H22N4 — CID 62490045

IUPACN-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
SMILESCc1cc(C)c(CNC(C)C)c(-n2ccc(C)n2)n1
InChIInChI=1S/C15H22N4/c1-10(2)16-9-14-11(3)8-13(5)17-15(14)19-7-6-12(4)18-19/h6-8,10,16H,9H2,1-5H3
InChIKeyVGNKQVIDKUGIFX-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.69
Rot. Bonds4

About N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine

N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 62490045) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
PubChem CID62490045
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
SMILESCc1cc(C)c(CNC(C)C)c(-n2ccc(C)n2)n1
InChIInChI=1S/C15H22N4/c1-10(2)16-9-14-11(3)8-13(5)17-15(14)19-7-6-12(4)18-19/h6-8,10,16H,9H2,1-5H3
InChIKeyVGNKQVIDKUGIFX-UHFFFAOYSA-N
XLogP2.69
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(chloromethyl)-4,6-dimethyl-2-(3-methylpyrazol-1-yl)pyridine
CID 62490039
N-[[2-(4-chloro-3,5-dimethylpyrazol-1-yl)-4,6-dimethyl-3-pyridinyl]methyl]propan-2-amine
CID 62295157
[4,6-dimethyl-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanamine
CID 62488465
N-[[4,6-dimethyl-2-(4-methylazepan-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 63623032
N-[[6-methyl-4-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 81255074
N-[[4,6-dimethyl-2-(3-methylmorpholin-4-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62281297
N-[[2-(2,2-dimethylmorpholin-4-yl)-4,6-dimethyl-3-pyridinyl]methyl]propan-2-amine
CID 62284000
1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine
CID 62294313
N'-[4,6-dimethyl-3-[(propan-2-ylamino)methyl]-2-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63700898
N-[(4,6-dimethyl-2-phenylmethoxy-3-pyridinyl)methyl]propan-2-amine
CID 62291538
N,4,6-trimethyl-N-pentyl-3-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62278726
N-[(4,6-dimethyl-2-prop-2-enoxy-3-pyridinyl)methyl]propan-2-amine
CID 55058277

Frequently Asked Questions

What is the IUPAC name of N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine (CID 62490045) is N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine is Cc1cc(C)c(CNC(C)C)c(-n2ccc(C)n2)n1.
What is the InChIKey of N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is VGNKQVIDKUGIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-10(2)16-9-14-11(3)8-13(5)17-15(14)19-7-6-12(4)18-19/h6-8,10,16H,9H2,1-5H3.
What are the key properties of N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 258.37 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4,6-dimethyl-2-(3-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 62490045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).