N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide

C14H22N2OS — CID 4231172

IUPACN-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide
SMILESCCCN(C(=O)c1cccs1)C1CCN(C)CC1
InChIInChI=1S/C14H22N2OS/c1-3-8-16(12-6-9-15(2)10-7-12)14(17)13-5-4-11-18-13/h4-5,11-12H,3,6-10H2,1-2H3
InChIKeyXJTXZHRSLMXAOA-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.69
Rot. Bonds4

About N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide

N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide (PubChem CID 4231172) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide
PubChem CID4231172
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide
SMILESCCCN(C(=O)c1cccs1)C1CCN(C)CC1
InChIInChI=1S/C14H22N2OS/c1-3-8-16(12-6-9-15(2)10-7-12)14(17)13-5-4-11-18-13/h4-5,11-12H,3,6-10H2,1-2H3
InChIKeyXJTXZHRSLMXAOA-UHFFFAOYSA-N
XLogP2.69
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-amino-2-methylpropyl)piperidin-4-yl]-N-propylthiophene-2-carboxamide
CID 120854150
N-[1-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]piperidin-4-yl]-N-propylthiophene-2-carboxamide
CID 124626949
N-[1-(6-cyanopyridazin-3-yl)piperidin-4-yl]-N-propylthiophene-2-carboxamide
CID 133421368
N-butyl-N-[(3R)-1,1-dioxothiolan-3-yl]thiophene-2-carboxamide
CID 7259974
N-cyclopropyl-N-(3-methylbutyl)thiophene-2-carboxamide
CID 60733247
N-[1-(4-oxo-3H-quinazolin-2-yl)piperidin-4-yl]-N-propylthiophene-2-carboxamide
CID 137265056
N-propyl-N-(thiophene-2-carbonyl)thiophene-2-carboxamide
CID 91704675
N-[1-(1H-indazol-6-ylmethyl)piperidin-4-yl]-N-propylthiophene-2-carboxamide
CID 126801368
(4-methylpiperazin-1-yl)-thiophen-2-ylmethanone;propane
CID 142296627
methyl 2-[cyclopentyl(thiophene-2-carbonyl)amino]acetate
CID 80709531
N-[[2-fluoro-5-(1H-indol-5-yl)phenyl]methyl]-N-(1-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 11525168
N-(piperidin-2-ylmethyl)-N-propylthiophene-2-carboxamide
CID 106625496

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide?
The IUPAC name of N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide (CID 4231172) is N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide?
The canonical SMILES for N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide is CCCN(C(=O)c1cccs1)C1CCN(C)CC1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide?
The InChIKey is XJTXZHRSLMXAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-3-8-16(12-6-9-15(2)10-7-12)14(17)13-5-4-11-18-13/h4-5,11-12H,3,6-10H2,1-2H3.
What are the key properties of N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide?
N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)-N-propylthiophene-2-carboxamide is sourced from PubChem (CID 4231172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).