5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine

C12H16N4 — CID 104535962

IUPAC5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine
SMILESCCCNc1cncc(-n2ccc(C)n2)c1
InChIInChI=1S/C12H16N4/c1-3-5-14-11-7-12(9-13-8-11)16-6-4-10(2)15-16/h4,6-9,14H,3,5H2,1-2H3
InChIKeyNBTUFBNGJXPKPC-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.40
Rot. Bonds4

About 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine

5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine (PubChem CID 104535962) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine.

Molecular Properties

Compound Name5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine
PubChem CID104535962
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine
SMILESCCCNc1cncc(-n2ccc(C)n2)c1
InChIInChI=1S/C12H16N4/c1-3-5-14-11-7-12(9-13-8-11)16-6-4-10(2)15-16/h4,6-9,14H,3,5H2,1-2H3
InChIKeyNBTUFBNGJXPKPC-UHFFFAOYSA-N
XLogP2.40
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(propylamino)-3-pyridinyl]pyrazole-3-carboxamide
CID 104535988
N-propyl-5-[4-(trifluoromethyl)pyrazol-1-yl]pyridin-3-amine
CID 104535971
N-ethyl-5-pyrazol-1-ylpyridin-3-amine
CID 104535894
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylpyridin-3-amine
CID 113424132
N-[1-[3-(3-methylpyrazol-1-yl)phenyl]ethyl]propan-1-amine
CID 79170582
3,5-dichloro-6-(3-methylpyrazol-1-yl)-N-propylpyridin-2-amine
CID 102760287
trimethyl-[2-[5-(3-methylpyrazol-1-yl)-3-pyridinyl]ethynyl]silane
CID 174070318
5-(2-ethyl-5-methylpyrrolidin-1-yl)-N-propylpyridin-3-amine
CID 104535710
5-N-(3,5-dimethylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532378
5-N-(5-chloro-2-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532088
2,5-dimethyl-6-(3-methylpyrazol-1-yl)-N-propylpyrimidin-4-amine
CID 80857923
5-N-(5-bromo-2-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104533102

Frequently Asked Questions

What is the IUPAC name of 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine?
The IUPAC name of 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine (CID 104535962) is 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine.
What is the SMILES notation for 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine?
The canonical SMILES for 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine is CCCNc1cncc(-n2ccc(C)n2)c1.
What is the InChIKey of 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine?
The InChIKey is NBTUFBNGJXPKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-3-5-14-11-7-12(9-13-8-11)16-6-4-10(2)15-16/h4,6-9,14H,3,5H2,1-2H3.
What are the key properties of 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine?
5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine has a molecular weight of 216.29 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylpyrazol-1-yl)-N-propylpyridin-3-amine is sourced from PubChem (CID 104535962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).