N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide

C14H15N5O — CID 62040532

IUPACN-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide
SMILESCn1ccnc1CCNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H15N5O/c1-19-9-8-15-12(19)6-7-16-14(20)13-10-4-2-3-5-11(10)17-18-13/h2-5,8-9H,6-7H2,1H3,(H,16,20)(H,17,18)
InChIKeyHRKVIABYANNZCI-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.27
Rot. Bonds4

About N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide

N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide (PubChem CID 62040532) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide
PubChem CID62040532
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide
SMILESCn1ccnc1CCNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H15N5O/c1-19-9-8-15-12(19)6-7-16-14(20)13-10-4-2-3-5-11(10)17-18-13/h2-5,8-9H,6-7H2,1H3,(H,16,20)(H,17,18)
InChIKeyHRKVIABYANNZCI-UHFFFAOYSA-N
XLogP1.27
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-1H-indazole-3-carboxamide
CID 63362646
2-fluoro-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 61215487
2-ethylsulfonyl-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 51102554
2-(2-fluorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
CID 110476005
N-[4-(2-oxo-1-pyridinyl)butyl]-1H-indazole-3-carboxamide
CID 60598282
N-(2-phenoxyethyl)-1H-indazole-3-carboxamide
CID 27758329
N-(3-amino-3-oxopropyl)-1H-indazole-3-carboxamide
CID 63081541
N-[2-(2-methoxyphenoxy)ethyl]-1H-indazole-3-carboxamide
CID 4785814
N-(4-aminobutyl)-1H-indazole-3-carboxamide
CID 64982743
N-(2-cyclopentylethyl)-1H-indazole-3-carboxamide
CID 60735601
N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide
CID 61149810
N-(2-methylpropyl)-1H-indazole-3-carboxamide
CID 42477800

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide (CID 62040532) is N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide is Cn1ccnc1CCNC(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide?
The InChIKey is HRKVIABYANNZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-19-9-8-15-12(19)6-7-16-14(20)13-10-4-2-3-5-11(10)17-18-13/h2-5,8-9H,6-7H2,1H3,(H,16,20)(H,17,18).
What are the key properties of N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide?
N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide has a molecular weight of 269.31 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylimidazol-2-yl)ethyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 62040532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).