N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine

C13H16N4 — CID 67499535

IUPACN-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine
SMILESCc1nn(-c2cccnc2)cc1NCC1CC1
InChIInChI=1S/C13H16N4/c1-10-13(15-7-11-4-5-11)9-17(16-10)12-3-2-6-14-8-12/h2-3,6,8-9,11,15H,4-5,7H2,1H3
InChIKeyOHBKSGLOXRGBRN-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.40
Rot. Bonds4

About N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine

N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine (PubChem CID 67499535) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine
PubChem CID67499535
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine
SMILESCc1nn(-c2cccnc2)cc1NCC1CC1
InChIInChI=1S/C13H16N4/c1-10-13(15-7-11-4-5-11)9-17(16-10)12-3-2-6-14-8-12/h2-3,6,8-9,11,15H,4-5,7H2,1H3
InChIKeyOHBKSGLOXRGBRN-UHFFFAOYSA-N
XLogP2.40
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methyl-1-pyridin-3-ylpyrazol-4-yl)acetamide
CID 144831982
1-(3-methyl-1-pyridin-3-ylpyrazol-4-yl)-3-prop-2-enylurea
CID 90359810
N-(cyclobutylmethyl)-1,3-dimethylpyrazol-4-amine
CID 102804461
3-bromo-N-methyl-1-pyridin-3-ylpyrazol-4-amine;hydrochloride
CID 142766793
3-methyl-1-phenyl-N-(pyridin-3-ylmethyl)pyrazole-4-sulfonamide
CID 42283279
2-methyl-N-[(4-methylcyclohexyl)methyl]pyridin-3-amine
CID 79042072
3-chloro-N-prop-2-enyl-1-pyridin-3-ylpyrazol-4-amine
CID 67499762
N-(cyclopropylmethyl)-5,6-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 133334209
3-(4-isothiocyanato-3-methylpyrazol-1-yl)pyridine
CID 86700630
N-cyclopropyl-N-(3-methyl-1-pyridin-3-ylpyrazol-4-yl)-3-methylsulfanylpropanamide
CID 69260896
4-N-(cyclopropylmethyl)pyridine-3,4-diamine
CID 28902438
1-ethyl-1-(3-methyl-1-pyridin-3-ylpyrazol-4-yl)-3-propylurea
CID 69260543

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine (CID 67499535) is N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine is Cc1nn(-c2cccnc2)cc1NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine?
The InChIKey is OHBKSGLOXRGBRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-10-13(15-7-11-4-5-11)9-17(16-10)12-3-2-6-14-8-12/h2-3,6,8-9,11,15H,4-5,7H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine?
N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine has a molecular weight of 228.30 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 N-(cyclopropylmethyl)-3-methyl-1-pyridin-3-ylpyrazol-4-amine is sourced from PubChem (CID 67499535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).