N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide

C15H20N4O2 — CID 61149810

IUPACN-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide
SMILESCCN(CC)C(=O)CCNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C15H20N4O2/c1-3-19(4-2)13(20)9-10-16-15(21)14-11-7-5-6-8-12(11)17-18-14/h5-8H,3-4,9-10H2,1-2H3,(H,16,21)(H,17,18)
InChIKeyFEQSSTLALBERDB-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.55
Rot. Bonds6

About N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide

N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide (PubChem CID 61149810) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide
PubChem CID61149810
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide
SMILESCCN(CC)C(=O)CCNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C15H20N4O2/c1-3-19(4-2)13(20)9-10-16-15(21)14-11-7-5-6-8-12(11)17-18-14/h5-8H,3-4,9-10H2,1-2H3,(H,16,21)(H,17,18)
InChIKeyFEQSSTLALBERDB-UHFFFAOYSA-N
XLogP1.55
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-3-oxopropyl)-1H-indazole-3-carboxamide
CID 63081541
ethyl 4-(1H-indazole-3-carbonylamino)butanoate
CID 60637293
[2-(diethylamino)-2-oxoethyl] 1H-indazole-3-carboxylate
CID 2534560
N-[3-(2-methylpropylamino)-3-oxopropyl]-1H-indazole-3-carboxamide
CID 115605737
N-[3-oxo-3-(4-propanoylpiperazin-1-yl)propyl]-1H-indazole-3-carboxamide
CID 99434343
N-[3-(N-ethylanilino)propyl]-1H-indazole-3-carboxamide
CID 41277786
[2-[ethyl-[(3-fluorophenyl)methyl]amino]-2-oxoethyl] 3-(1H-indazole-3-carbonylamino)propanoate
CID 51135167
N,N-diethyl-2-[(1H-indazole-3-carbonylamino)methyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 53195608
N-(4-aminobutyl)-1H-indazole-3-carboxamide
CID 64982743
N-(2-methylpropyl)-1H-indazole-3-carboxamide
CID 42477800
4-[3-(1H-indazole-3-carbonylamino)propanoylamino]-4-methylpentanoic acid
CID 119357288
N-(2-phenoxyethyl)-1H-indazole-3-carboxamide
CID 27758329

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide (CID 61149810) is N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide is CCN(CC)C(=O)CCNC(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide?
The InChIKey is FEQSSTLALBERDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-3-19(4-2)13(20)9-10-16-15(21)14-11-7-5-6-8-12(11)17-18-14/h5-8H,3-4,9-10H2,1-2H3,(H,16,21)(H,17,18).
What are the key properties of N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide?
N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)-3-oxopropyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 61149810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).