6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide

C15H22N4O — CID 65290989

IUPAC6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide
SMILESCC(N)CCCC(C)C(=O)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H22N4O/c1-10(4-3-5-11(2)16)15(20)18-13-6-7-14-12(8-13)9-17-19-14/h6-11H,3-5,16H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyQXABKEVVOHYEHX-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.65
Rot. Bonds6

About 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide

6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide (PubChem CID 65290989) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide.

Molecular Properties

Compound Name6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide
PubChem CID65290989
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide
SMILESCC(N)CCCC(C)C(=O)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H22N4O/c1-10(4-3-5-11(2)16)15(20)18-13-6-7-14-12(8-13)9-17-19-14/h6-11H,3-5,16H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyQXABKEVVOHYEHX-UHFFFAOYSA-N
XLogP2.65
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(1H-indazol-5-yl)-4-methylpentanamide
CID 43704662
[(2S)-6-amino-1-(1H-indazol-5-ylamino)-1-oxohexan-2-yl]carbamic acid
CID 90892202
2-ethyl-N-(1H-indazol-5-yl)butanamide
CID 17164523
2-bromo-N-(1H-indazol-5-yl)-3-methylbutanamide
CID 43698098
2-(aminomethyl)-N-(1H-indazol-5-yl)butanamide
CID 65224950
6-amino-N-(1H-indazol-4-yl)-2-methylheptanamide
CID 65290576
(2S)-2-amino-N-[2-(1H-indazol-5-ylamino)-2-oxoethyl]-3-methylbutanamide
CID 82963463
6-amino-N-(4-fluoro-3-methylphenyl)-2-methylheptanamide
CID 65291128
5-[(6-amino-2-methylheptanoyl)amino]-2-methylbenzoic acid
CID 65291238
6-amino-N-(3-fluorophenyl)-2-methylheptanamide
CID 65292739
6-amino-N-(3,5-dimethylphenyl)-2-methylheptanamide
CID 65292589
6-amino-N-(3-hydroxy-4-methoxyphenyl)-2-methylheptanamide
CID 65290661

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide?
The IUPAC name of 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide (CID 65290989) is 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide.
What is the SMILES notation for 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide?
The canonical SMILES for 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide is CC(N)CCCC(C)C(=O)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide?
The InChIKey is QXABKEVVOHYEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-10(4-3-5-11(2)16)15(20)18-13-6-7-14-12(8-13)9-17-19-14/h6-11H,3-5,16H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide?
6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide has a molecular weight of 274.37 g/mol, XLogP of 2.65, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(1H-indazol-5-yl)-2-methylheptanamide is sourced from PubChem (CID 65290989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).