N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide

C16H22N2O2S — CID 45207272

IUPACN-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide
SMILESO=C(CCC1CCCN(C(=O)c2ccsc2)C1)NC1CC1
InChIInChI=1S/C16H22N2O2S/c19-15(17-14-4-5-14)6-3-12-2-1-8-18(10-12)16(20)13-7-9-21-11-13/h7,9,11-12,14H,1-6,8,10H2,(H,17,19)
InChIKeyHIVHNTFTDQYAIQ-UHFFFAOYSA-N
MW306.43 g/mol
LogP2.66
Rot. Bonds5

About N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide

N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide (PubChem CID 45207272) has the molecular formula C16H22N2O2S and a molecular weight of 306.43 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide
PubChem CID45207272
Molecular FormulaC16H22N2O2S
Molecular Weight306.43 g/mol
Exact Mass306.14
IUPAC NameN-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide
SMILESO=C(CCC1CCCN(C(=O)c2ccsc2)C1)NC1CC1
InChIInChI=1S/C16H22N2O2S/c19-15(17-14-4-5-14)6-3-12-2-1-8-18(10-12)16(20)13-7-9-21-11-13/h7,9,11-12,14H,1-6,8,10H2,(H,17,19)
InChIKeyHIVHNTFTDQYAIQ-UHFFFAOYSA-N
XLogP2.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide
CID 72886779
[3-(hydroxymethyl)piperidin-1-yl]-thiophen-3-ylmethanone
CID 43422291
N-cyclopropyl-3-[(3S)-1-[4-(dimethylamino)benzoyl]piperidin-3-yl]propanamide
CID 26397692
N-cyclopropyl-3-[(3S)-1-(4-propan-2-yloxybenzoyl)piperidin-3-yl]propanamide
CID 42308218
N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide
CID 42515547
(3R)-1-(thiophene-3-carbonyl)piperidine-3-carboxylic acid
CID 30044914
[3-(pyridin-2-ylmethyl)piperidin-1-yl]-thiophen-3-ylmethanone
CID 175652360
[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]-thiophen-3-ylmethanone
CID 125000817
3-[3-(cyclopentylamino)-3-oxopropyl]-N-(4-fluorophenyl)piperidine-1-carboxamide
CID 53138057
3-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]-N-cyclopropylpropanamide
CID 45186054
[(3R)-3-[(6-methyl-3-pyridinyl)methyl]piperidin-1-yl]-thiophen-3-ylmethanone
CID 125024367
N-cyclopropyl-3-[1-[2-(1-methylpyrrol-3-yl)acetyl]piperidin-3-yl]propanamide
CID 45235322

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide (CID 45207272) is N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide is O=C(CCC1CCCN(C(=O)c2ccsc2)C1)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide?
The InChIKey is HIVHNTFTDQYAIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2S/c19-15(17-14-4-5-14)6-3-12-2-1-8-18(10-12)16(20)13-7-9-21-11-13/h7,9,11-12,14H,1-6,8,10H2,(H,17,19).
What are the key properties of N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide?
N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide has a molecular weight of 306.43 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[1-(thiophene-3-carbonyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 45207272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).