7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide

C19H21N3O2 — CID 66666858

IUPAC7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide
SMILESCC(=O)c1ccc2c(C(=O)NCCN(C)C)c3ccccc3n2c1
InChIInChI=1S/C19H21N3O2/c1-13(23)14-8-9-17-18(19(24)20-10-11-21(2)3)15-6-4-5-7-16(15)22(17)12-14/h4-9,12H,10-11H2,1-3H3,(H,20,24)
InChIKeyPHFZSUFOTCXBGB-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.59
Rot. Bonds5

About 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide

7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide (PubChem CID 66666858) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide.

Molecular Properties

Compound Name7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide
PubChem CID66666858
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide
SMILESCC(=O)c1ccc2c(C(=O)NCCN(C)C)c3ccccc3n2c1
InChIInChI=1S/C19H21N3O2/c1-13(23)14-8-9-17-18(19(24)20-10-11-21(2)3)15-6-4-5-7-16(15)22(17)12-14/h4-9,12H,10-11H2,1-3H3,(H,20,24)
InChIKeyPHFZSUFOTCXBGB-UHFFFAOYSA-N
XLogP2.59
TPSA53.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-acetyl-N-[2-(dimethylamino)ethyl]-N-methylpyrido[1,2-a]indole-10-carboxamide
CID 66667158
3-N,10-N-bis[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-3,10-dicarboxamide
CID 66667040
N-[2-(dimethylamino)ethyl]-4-hydroxy-2-oxo-1-phenylquinoline-3-carboxamide
CID 71814744
N-[2-(dimethylamino)ethyl]-1-ethyl-4-hydroxy-2-oxoquinoline-3-carboxamide;hydrochloride
CID 54736678
N-[2-(dimethylamino)ethyl]carbazole-9-carboxamide
CID 3027990
N-[2-(dimethylamino)ethyl]-4-hydroxy-2-oxo-1-propylquinoline-3-carboxamide
CID 54688406
N-benzyl-7-methoxypyrido[1,2-a]indole-10-carboxamide
CID 66667583
N-[2-(dimethylamino)ethyl]-2,6-difluorobenzamide
CID 17249262
N-[2-(dimethylamino)ethyl]-4-sulfanylbenzamide
CID 107019569
1-acetyl-N-[3-(dimethylamino)propyl]indole-3-carboxamide
CID 113207837
N-[2-(dimethylamino)ethyl]-1-benzothiophene-3-carboxamide
CID 13058563
2-(dimethylamino)ethyl 7-cyanopyrido[1,2-a]indole-10-carboxylate
CID 66667646

Frequently Asked Questions

What is the IUPAC name of 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide?
The IUPAC name of 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide (CID 66666858) is 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide.
What is the SMILES notation for 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide?
The canonical SMILES for 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide is CC(=O)c1ccc2c(C(=O)NCCN(C)C)c3ccccc3n2c1.
What is the InChIKey of 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide?
The InChIKey is PHFZSUFOTCXBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-13(23)14-8-9-17-18(19(24)20-10-11-21(2)3)15-6-4-5-7-16(15)22(17)12-14/h4-9,12H,10-11H2,1-3H3,(H,20,24).
What are the key properties of 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide?
7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-acetyl-N-[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-10-carboxamide is sourced from PubChem (CID 66666858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).