5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide

C10H14N2OS — CID 115735684

IUPAC5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide
SMILESCC1(NCc2cc(C(N)=O)cs2)CC1
InChIInChI=1S/C10H14N2OS/c1-10(2-3-10)12-5-8-4-7(6-14-8)9(11)13/h4,6,12H,2-3,5H2,1H3,(H2,11,13)
InChIKeyDTCKTBZIDXIGFN-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.49
Rot. Bonds4

About 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide

5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide (PubChem CID 115735684) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide
PubChem CID115735684
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide
SMILESCC1(NCc2cc(C(N)=O)cs2)CC1
InChIInChI=1S/C10H14N2OS/c1-10(2-3-10)12-5-8-4-7(6-14-8)9(11)13/h4,6,12H,2-3,5H2,1H3,(H2,11,13)
InChIKeyDTCKTBZIDXIGFN-UHFFFAOYSA-N
XLogP1.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[[(4-methyloxan-4-yl)amino]methyl]thiophene-3-carboxamide
CID 115758077
5-[[(2-methyl-3,4-dihydro-1H-naphthalen-2-yl)amino]methyl]thiophene-3-carboxamide
CID 75384467
5-[[(2,2-dimethylcyclopropyl)amino]methyl]thiophene-3-carboxamide
CID 79614212
5-[[(1-ethylcyclopentyl)methylamino]methyl]thiophene-3-carboxamide
CID 103802126
5-[(2,3-dimethylbutylamino)methyl]thiophene-3-carboxamide
CID 79613545
5-[[(1-cyclopropylcyclopropyl)methylamino]methyl]thiophene-3-carboxamide
CID 113321738
5-[(pentan-3-ylamino)methyl]thiophene-3-carboxamide
CID 79605956
methyl (2S)-2-[(4-carbamoylthiophen-2-yl)methylamino]propanoate
CID 79613507
5-[(5-methylhexan-2-ylamino)methyl]thiophene-3-carboxamide
CID 79606562
5-[[[1-(hydroxymethyl)cyclohexyl]methylamino]methyl]thiophene-3-carboxamide
CID 112701033
5-(butylaminomethyl)thiophene-3-carboxamide
CID 79606629
3-[[(1-methylcyclopropyl)amino]methyl]benzamide
CID 115635058

Frequently Asked Questions

What is the IUPAC name of 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide?
The IUPAC name of 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide (CID 115735684) is 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide.
What is the SMILES notation for 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide?
The canonical SMILES for 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide is CC1(NCc2cc(C(N)=O)cs2)CC1.
What is the InChIKey of 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide?
The InChIKey is DTCKTBZIDXIGFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-10(2-3-10)12-5-8-4-7(6-14-8)9(11)13/h4,6,12H,2-3,5H2,1H3,(H2,11,13).
What are the key properties of 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide?
5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide has a molecular weight of 210.30 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1-methylcyclopropyl)amino]methyl]thiophene-3-carboxamide is sourced from PubChem (CID 115735684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).