2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide

C19H26FN3O2 — CID 97142895

IUPAC2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(C(=O)N2CCCC[C@H]2c2ccc(F)cc2)CC1
InChIInChI=1S/C19H26FN3O2/c20-16-6-4-14(5-7-16)17-3-1-2-10-23(17)19(25)15-8-11-22(12-9-15)13-18(21)24/h4-7,15,17H,1-3,8-13H2,(H2,21,24)/t17-/m0/s1
InChIKeyOKELGENWLNVMMI-KRWDZBQOSA-N
MW347.43 g/mol
LogP2.08
Rot. Bonds4

About 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide

2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide (PubChem CID 97142895) has the molecular formula C19H26FN3O2 and a molecular weight of 347.43 g/mol. Its IUPAC name is 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide
PubChem CID97142895
Molecular FormulaC19H26FN3O2
Molecular Weight347.43 g/mol
Exact Mass347.20
IUPAC Name2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(C(=O)N2CCCC[C@H]2c2ccc(F)cc2)CC1
InChIInChI=1S/C19H26FN3O2/c20-16-6-4-14(5-7-16)17-3-1-2-10-23(17)19(25)15-8-11-22(12-9-15)13-18(21)24/h4-7,15,17H,1-3,8-13H2,(H2,21,24)/t17-/m0/s1
InChIKeyOKELGENWLNVMMI-KRWDZBQOSA-N
XLogP2.08
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(2S)-2-(4-fluorophenyl)azetidine-1-carbonyl]piperidin-1-yl]acetamide
CID 97122736
2-amino-1-[2-(4-fluorophenyl)piperidin-1-yl]ethanone;hydrochloride
CID 119338691
1-[2-[(2S)-2-(4-fluorophenyl)azetidin-1-yl]-2-oxoethyl]piperidine-4-carboxamide
CID 97128985
cyclopropyl-[4-[(2R)-2-(4-fluorophenyl)azetidine-1-carbonyl]piperidin-1-yl]methanone
CID 97149488
3-[(2S)-2-(4-fluorophenyl)piperidin-1-yl]propanamide
CID 95715360
[2-(4-fluorophenyl)piperidin-1-yl]-[(2S,4S)-2-methylpiperidin-4-yl]methanone
CID 120637114
3,3-difluoro-1-[(2R)-2-(4-fluorophenyl)piperidin-1-yl]butan-1-one
CID 124890583
7-amino-1-[2-(4-fluorophenyl)piperidin-1-yl]heptan-1-one;hydrochloride
CID 119810095
cyclohexyl-(2-phenylpiperidin-1-yl)methanone
CID 161290286
[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-(4-methylpiperazin-1-yl)methanone
CID 95729352
(3S)-4-amino-1-[(2S)-2-(4-fluorophenyl)piperidin-1-yl]-3-methoxybutan-1-one
CID 125120184
(5-amino-2-methylphenyl)-[2-(4-fluorophenyl)piperidin-1-yl]methanone;hydrochloride
CID 120637115

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide (CID 97142895) is 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide is NC(=O)CN1CCC(C(=O)N2CCCC[C@H]2c2ccc(F)cc2)CC1.
What is the InChIKey of 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide?
The InChIKey is OKELGENWLNVMMI-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H26FN3O2/c20-16-6-4-14(5-7-16)17-3-1-2-10-23(17)19(25)15-8-11-22(12-9-15)13-18(21)24/h4-7,15,17H,1-3,8-13H2,(H2,21,24)/t17-/m0/s1.
What are the key properties of 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide?
2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide has a molecular weight of 347.43 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2S)-2-(4-fluorophenyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 97142895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).