N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide

C14H20N4O — CID 63888929

IUPACN-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide
SMILESCC(C)CC(CN)NC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C14H20N4O/c1-9(2)5-12(7-15)17-14(19)10-3-4-11-8-16-18-13(11)6-10/h3-4,6,8-9,12H,5,7,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyMKFCXIGBLSQBTI-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.67
Rot. Bonds5

About N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide

N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide (PubChem CID 63888929) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide
PubChem CID63888929
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide
SMILESCC(C)CC(CN)NC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C14H20N4O/c1-9(2)5-12(7-15)17-14(19)10-3-4-11-8-16-18-13(11)6-10/h3-4,6,8-9,12H,5,7,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyMKFCXIGBLSQBTI-UHFFFAOYSA-N
XLogP1.67
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminobutan-2-yl)-1H-indazole-6-carboxamide
CID 65193937
(2S)-2-(1H-indazole-6-carbonylamino)-4-methylpentanoic acid
CID 61154648
N-(3-methylbutan-2-yl)-1H-indazole-6-carboxamide
CID 55023710
(2R)-2-(1H-indazole-6-carbonylamino)propanoic acid
CID 51888645
N-(3-aminobutyl)-1H-indazole-6-carboxamide
CID 63253437
N-(1-hydroxy-4-methylpentan-3-yl)-1H-indazole-6-carboxamide
CID 106352905
N-(1-phenylpropan-2-yl)-1H-indazole-6-carboxamide
CID 63010618
N-(1-amino-4-methylpentan-2-yl)-3,4-dichlorobenzamide;hydrochloride
CID 119585468
N-(1-amino-4-methylpentan-2-yl)-2-methyl-1,3-dioxoisoindole-5-carboxamide
CID 119587154
(2R)-3-hydroxy-2-(1H-indazole-6-carbonylamino)propanoic acid
CID 80751119
N-(4-hydroxy-3-methylsulfanylbutan-2-yl)-1H-indazole-6-carboxamide
CID 106156100
N-(1-amino-2-methylpropan-2-yl)-1H-indazole-6-carboxamide
CID 63194069

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide (CID 63888929) is N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide is CC(C)CC(CN)NC(=O)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide?
The InChIKey is MKFCXIGBLSQBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9(2)5-12(7-15)17-14(19)10-3-4-11-8-16-18-13(11)6-10/h3-4,6,8-9,12H,5,7,15H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide?
N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.67, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 63888929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).