1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide

C17H17FN4O — CID 23582643

IUPAC1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide
SMILESNC(=O)c1cnc(NC2CCCC2)c2c1[nH]c1ccc(F)cc12
InChIInChI=1S/C17H17FN4O/c18-9-5-6-13-11(7-9)14-15(22-13)12(16(19)23)8-20-17(14)21-10-3-1-2-4-10/h5-8,10,22H,1-4H2,(H2,19,23)(H,20,21)
InChIKeyDZPVFVSIJWSCAA-UHFFFAOYSA-N
MW312.35 g/mol
LogP3.31
Rot. Bonds3

About 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide

1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide (PubChem CID 23582643) has the molecular formula C17H17FN4O and a molecular weight of 312.35 g/mol. Its IUPAC name is 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide
PubChem CID23582643
Molecular FormulaC17H17FN4O
Molecular Weight312.35 g/mol
Exact Mass312.14
IUPAC Name1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide
SMILESNC(=O)c1cnc(NC2CCCC2)c2c1[nH]c1ccc(F)cc12
InChIInChI=1S/C17H17FN4O/c18-9-5-6-13-11(7-9)14-15(22-13)12(16(19)23)8-20-17(14)21-10-3-1-2-4-10/h5-8,10,22H,1-4H2,(H2,19,23)(H,20,21)
InChIKeyDZPVFVSIJWSCAA-UHFFFAOYSA-N
XLogP3.31
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.35
LogP ≤ 53.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tryptamide
CID 65768
Y-39983
CID 11507964
Delavuridine
CID 72346
(E)-N-(3-((6-(1H-Indol-3-yl)pyrimidin-4-yl)amino)phenyl)-4-(4-(dimethylamino)but-2-enamido)benzamide
CID 134451950
Fumiquinazoline F
CID 10089772
2-((2-((2-Methyl-4-(1-propyl-1,2,5,6-tetrahydropyridin-3-yl)phenyl)amino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)benzamide
CID 25218593
Piperazine, 1-(3-(ethylamino)-2-pyridinyl)-4-(1H-indol-2-ylcarbonyl)-
CID 453217
Fiscalin B
CID 10091548
Piperazine, 1-((6-fluoro-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-
CID 453391
1H-indol-2-yl-[4-[[3-(isopropylamino)-2-pyridyl]-methyl-amino]-1-piperidyl]methanone
CID 462952
6H-Dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one, 11-ethyl-5,11-dihydro-5-methyl-2-(1H-pyrrolo(2,3-c)pyridin-3-yl)-
CID 466848
7-{[(1r,2s)-2-Aminocyclohexyl]amino}-5-(1h-Indol-7-Ylamino)pyrido[4,3-D]pyrimidin-4(3h)-One
CID 135566923

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide?
The IUPAC name of 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide (CID 23582643) is 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide.
What is the SMILES notation for 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide?
The canonical SMILES for 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide is NC(=O)c1cnc(NC2CCCC2)c2c1[nH]c1ccc(F)cc12.
What is the InChIKey of 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide?
The InChIKey is DZPVFVSIJWSCAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN4O/c18-9-5-6-13-11(7-9)14-15(22-13)12(16(19)23)8-20-17(14)21-10-3-1-2-4-10/h5-8,10,22H,1-4H2,(H2,19,23)(H,20,21).
What are the key properties of 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide?
1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide has a molecular weight of 312.35 g/mol, XLogP of 3.31, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide is sourced from PubChem (CID 23582643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).