5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine

C11H15N5 — CID 63154330

IUPAC5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine
SMILESCC(C)c1nc(-c2cncc(N)c2)n(C)n1
InChIInChI=1S/C11H15N5/c1-7(2)10-14-11(16(3)15-10)8-4-9(12)6-13-5-8/h4-7H,12H2,1-3H3
InChIKeyMRSNBGSGKKMBAV-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.58
Rot. Bonds2

About 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine

5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine (PubChem CID 63154330) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine
PubChem CID63154330
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine
SMILESCC(C)c1nc(-c2cncc(N)c2)n(C)n1
InChIInChI=1S/C11H15N5/c1-7(2)10-14-11(16(3)15-10)8-4-9(12)6-13-5-8/h4-7H,12H2,1-3H3
InChIKeyMRSNBGSGKKMBAV-UHFFFAOYSA-N
XLogP1.58
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)-5-(trifluoromethyl)aniline
CID 62721430
4-fluoro-3-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)aniline
CID 62720704
N-methyl-3-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)aniline
CID 82474594
5-(6-chloro-1-propan-2-ylbenzimidazol-2-yl)pyridin-3-amine
CID 115473071
5-(7-chloro-1-ethylbenzimidazol-2-yl)pyridin-3-amine
CID 55166004
5-(1-methyltriazol-4-yl)pyridin-3-amine
CID 130602643
5-(1-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)pyridin-3-amine
CID 72919049
5-(1-methylindol-2-yl)pyridin-3-amine
CID 58215579
5-(3-ethylimidazo[4,5-b]pyridin-2-yl)pyridin-3-amine
CID 63757128
4-[2-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)propan-2-yl]aniline
CID 115825905
5-(5-chloro-3-pyridinyl)pyridin-3-amine
CID 141394727
5-[(1R)-1-aminoethyl]pyridin-3-amine
CID 55275207

Frequently Asked Questions

What is the IUPAC name of 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine?
The IUPAC name of 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine (CID 63154330) is 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine.
What is the SMILES notation for 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine?
The canonical SMILES for 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine is CC(C)c1nc(-c2cncc(N)c2)n(C)n1.
What is the InChIKey of 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine?
The InChIKey is MRSNBGSGKKMBAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-7(2)10-14-11(16(3)15-10)8-4-9(12)6-13-5-8/h4-7H,12H2,1-3H3.
What are the key properties of 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine?
5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine has a molecular weight of 217.28 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)pyridin-3-amine is sourced from PubChem (CID 63154330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).