N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide

C19H22N2O2S — CID 43047282

IUPACN-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
SMILESO=C(NCC1CC1)c1cc(-c2ccccc2)c(N2CCOCC2)s1
InChIInChI=1S/C19H22N2O2S/c22-18(20-13-14-6-7-14)17-12-16(15-4-2-1-3-5-15)19(24-17)21-8-10-23-11-9-21/h1-5,12,14H,6-11,13H2,(H,20,22)
InChIKeyKNBFMRIZOCRBGP-UHFFFAOYSA-N
MW342.46 g/mol
LogP3.39
Rot. Bonds5

About N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide

N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide (PubChem CID 43047282) has the molecular formula C19H22N2O2S and a molecular weight of 342.46 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
PubChem CID43047282
Molecular FormulaC19H22N2O2S
Molecular Weight342.46 g/mol
Exact Mass342.14
IUPAC NameN-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
SMILESO=C(NCC1CC1)c1cc(-c2ccccc2)c(N2CCOCC2)s1
InChIInChI=1S/C19H22N2O2S/c22-18(20-13-14-6-7-14)17-12-16(15-4-2-1-3-5-15)19(24-17)21-8-10-23-11-9-21/h1-5,12,14H,6-11,13H2,(H,20,22)
InChIKeyKNBFMRIZOCRBGP-UHFFFAOYSA-N
XLogP3.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.46
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 9319192
N-[(3,5-dimethoxyphenyl)methyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 55577868
azetidin-1-yl-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24515046
N-[(3-ethoxyphenyl)methyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 55783627
N-[3-(3-methylpiperidin-1-yl)propyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 20940421
N-[(3R)-1-benzylpyrrolidin-3-yl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 41200888
N-[(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 56576443
N-[4-(ethylcarbamoyl)phenyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 55753857
5-morpholin-4-yl-N-[(2R)-1-oxo-1-(propylamino)propan-2-yl]-4-phenylthiophene-2-carboxamide
CID 27861002
N-[[4-[(2-amino-2-oxoethyl)carbamoyl]phenyl]methyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide
CID 46494653
methyl 3-[(5-morpholin-4-yl-4-phenylthiophene-2-carbonyl)amino]-3-phenylpropanoate
CID 24516873
(3,5-dimethylpiperidin-1-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24538398

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide (CID 43047282) is N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide is O=C(NCC1CC1)c1cc(-c2ccccc2)c(N2CCOCC2)s1.
What is the InChIKey of N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide?
The InChIKey is KNBFMRIZOCRBGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2S/c22-18(20-13-14-6-7-14)17-12-16(15-4-2-1-3-5-15)19(24-17)21-8-10-23-11-9-21/h1-5,12,14H,6-11,13H2,(H,20,22).
What are the key properties of N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide?
N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide has a molecular weight of 342.46 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide is sourced from PubChem (CID 43047282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).