N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide

C17H20N2O3S — CID 126771419

IUPACN-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide
SMILESCOc1cc(C)sc1C(=O)NCc1ccc(OCC2CC2)nc1
InChIInChI=1S/C17H20N2O3S/c1-11-7-14(21-2)16(23-11)17(20)19-9-13-5-6-15(18-8-13)22-10-12-3-4-12/h5-8,12H,3-4,9-10H2,1-2H3,(H,19,20)
InChIKeySPGFUGZXSCBTGI-UHFFFAOYSA-N
MW332.43 g/mol
LogP3.18
Rot. Bonds7

About N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide

N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide (PubChem CID 126771419) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide
PubChem CID126771419
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide
SMILESCOc1cc(C)sc1C(=O)NCc1ccc(OCC2CC2)nc1
InChIInChI=1S/C17H20N2O3S/c1-11-7-14(21-2)16(23-11)17(20)19-9-13-5-6-15(18-8-13)22-10-12-3-4-12/h5-8,12H,3-4,9-10H2,1-2H3,(H,19,20)
InChIKeySPGFUGZXSCBTGI-UHFFFAOYSA-N
XLogP3.18
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide with MolForge

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Related Compounds

N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(2-methoxyphenyl)acetamide
CID 51102664
1-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-[(3,4-dimethoxyphenyl)methyl]-2-methylguanidine
CID 111201988
N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 99702373
1-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-[(4-methoxyphenyl)methyl]-2-methylguanidine
CID 111181887
1-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-methyl-3-[(5-methyl-1,3-thiazol-2-yl)methyl]guanidine
CID 111525436
3-methoxy-5-methyl-N-[(4-morpholin-4-ylphenyl)methyl]thiophene-2-carboxamide
CID 166205855
4-[4-[[(3-methoxy-5-methylthiophene-2-carbonyl)amino]methyl]phenoxy]butanoic acid
CID 119247225
N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-4-methylpiperidine-1-carboxamide
CID 60610851
N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-hydroxy-3-phenylbutanamide
CID 110025154
1-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-(pyridin-3-ylmethyl)urea
CID 60610661
N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430830
1-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-methyl-3-[(3-methylphenyl)methyl]guanidine
CID 111899891

Frequently Asked Questions

What is the IUPAC name of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide (CID 126771419) is N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide is COc1cc(C)sc1C(=O)NCc1ccc(OCC2CC2)nc1.
What is the InChIKey of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide?
The InChIKey is SPGFUGZXSCBTGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-11-7-14(21-2)16(23-11)17(20)19-9-13-5-6-15(18-8-13)22-10-12-3-4-12/h5-8,12H,3-4,9-10H2,1-2H3,(H,19,20).
What are the key properties of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide?
N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide has a molecular weight of 332.43 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-methoxy-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 126771419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).