2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide

C10H13N3O — CID 12665738

IUPAC2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide
SMILESNC(=O)c1cc2c(nc1N)CCCC2
InChIInChI=1S/C10H13N3O/c11-9-7(10(12)14)5-6-3-1-2-4-8(6)13-9/h5H,1-4H2,(H2,11,13)(H2,12,14)
InChIKeyPYZSQFCSBZEHBJ-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.64
Rot. Bonds1

About 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide

2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide (PubChem CID 12665738) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide.

Molecular Properties

Compound Name2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide
PubChem CID12665738
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide
SMILESNC(=O)c1cc2c(nc1N)CCCC2
InChIInChI=1S/C10H13N3O/c11-9-7(10(12)14)5-6-3-1-2-4-8(6)13-9/h5H,1-4H2,(H2,11,13)(H2,12,14)
InChIKeyPYZSQFCSBZEHBJ-UHFFFAOYSA-N
XLogP0.64
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Aminoquinoline-3-carboxamide
CID 5200228
5,7-dimethylpyrido[2,3-d]pyrimidin-4(3H)-one
CID 135408240
2-Amino-4,6-dimethylpyridine-3-carboxamide
CID 252216
1,8-Naphthyridin-4-ol, 7-methyl-2-propyl-
CID 13155595
3-Acyl-2,6-diaminopyridine deriv. 3b
CID 5330841
(2,6-Diaminopyridin-3-yl)(phenyl)methanone
CID 5330842
2-Methylsulfanyl-3-o-tolyl-6,7,8,9-tetrahydro-3H-pyrimido[4,5-b]quinolin-4-one
CID 929434
3-allyl-2-thioxo-2,3,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-4(1H)-one
CID 5389100
2-Phenyl-7-methyl-1,8-naphthyridine-4-ol
CID 5467768
7-Methyl-2-m-tolyl-1H-[1,8]naphthyridin-4-one
CID 5468782
3-phenyl-2-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one
CID 5418960
5-Deazaflavin
CID 5376058

Frequently Asked Questions

What is the IUPAC name of 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide?
The IUPAC name of 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide (CID 12665738) is 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide.
What is the SMILES notation for 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide?
The canonical SMILES for 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide is NC(=O)c1cc2c(nc1N)CCCC2.
What is the InChIKey of 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide?
The InChIKey is PYZSQFCSBZEHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c11-9-7(10(12)14)5-6-3-1-2-4-8(6)13-9/h5H,1-4H2,(H2,11,13)(H2,12,14).
What are the key properties of 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide?
2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide has a molecular weight of 191.23 g/mol, XLogP of 0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5,6,7,8-tetrahydroquinoline-3-carboxamide is sourced from PubChem (CID 12665738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).