N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide

C18H20FN7O2 — CID 166371779

IUPACN-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide
SMILESCc1cc(F)cc2[nH]c(C(=O)N3CCC3CNC(=O)CCn3cnnn3)cc12
InChIInChI=1S/C18H20FN7O2/c1-11-6-12(19)7-15-14(11)8-16(22-15)18(28)26-5-2-13(26)9-20-17(27)3-4-25-10-21-23-24-25/h6-8,10,13,22H,2-5,9H2,1H3,(H,20,27)
InChIKeyKNOAARHUFCPVKL-UHFFFAOYSA-N
MW385.40 g/mol
LogP1.02
Rot. Bonds6

About N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide

N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide (PubChem CID 166371779) has the molecular formula C18H20FN7O2 and a molecular weight of 385.40 g/mol. Its IUPAC name is N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide
PubChem CID166371779
Molecular FormulaC18H20FN7O2
Molecular Weight385.40 g/mol
Exact Mass385.17
IUPAC NameN-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide
SMILESCc1cc(F)cc2[nH]c(C(=O)N3CCC3CNC(=O)CCn3cnnn3)cc12
InChIInChI=1S/C18H20FN7O2/c1-11-6-12(19)7-15-14(11)8-16(22-15)18(28)26-5-2-13(26)9-20-17(27)3-4-25-10-21-23-24-25/h6-8,10,13,22H,2-5,9H2,1H3,(H,20,27)
InChIKeyKNOAARHUFCPVKL-UHFFFAOYSA-N
XLogP1.02
TPSA108.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.40
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide 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

(6-fluoro-4-methyl-1H-indol-2-yl)-[(2S,4R)-2-(hydroxymethyl)-4-methoxypyrrolidin-1-yl]methanone
CID 128984786
1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide
CID 119135616
[(3R,4R)-3,4-diaminopyrrolidin-1-yl]-(6-fluoro-4-methyl-1H-indol-2-yl)methanone
CID 155954106
N-[[3-cyclopropyl-1-(1H-indole-2-carbonyl)pyrrolidin-2-yl]methyl]butanamide
CID 155964509
N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide
CID 166290871
2-[(6-fluoro-4-methyl-1H-indole-2-carbonyl)amino]acetic acid
CID 75513250
N-[[(2S,3S)-2-tert-butyloxan-3-yl]methyl]-6-fluoro-4-methyl-1H-indole-2-carboxamide
CID 99809059
2-[(2R)-4-(6-fluoro-4-methyl-1H-indole-2-carbonyl)morpholin-2-yl]acetic acid
CID 124695833
1-[4-(5-fluoro-1H-indole-2-carbonyl)piperazin-1-yl]-2-(tetrazol-1-yl)ethanone
CID 78905242
1-[4-(4-fluorophenoxy)piperidin-1-yl]-3-(tetrazol-1-yl)propan-1-one
CID 70711037
(2-cyclobutylpyrrolidin-1-yl)-(4,6-dimethyl-1H-indol-2-yl)methanone
CID 91642214
N-[[(3S)-1-cycloheptylpiperidin-3-yl]methyl]-3-(tetrazol-1-yl)propanamide
CID 95225748

Frequently Asked Questions

What is the IUPAC name of N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide?
The IUPAC name of N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide (CID 166371779) is N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide.
What is the SMILES notation for N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide?
The canonical SMILES for N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide is Cc1cc(F)cc2[nH]c(C(=O)N3CCC3CNC(=O)CCn3cnnn3)cc12.
What is the InChIKey of N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide?
The InChIKey is KNOAARHUFCPVKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN7O2/c1-11-6-12(19)7-15-14(11)8-16(22-15)18(28)26-5-2-13(26)9-20-17(27)3-4-25-10-21-23-24-25/h6-8,10,13,22H,2-5,9H2,1H3,(H,20,27).
What are the key properties of N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide?
N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide has a molecular weight of 385.40 g/mol, XLogP of 1.02, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide is sourced from PubChem (CID 166371779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).