N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide

C16H19N3OS — CID 62174755

IUPACN-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(Cc2ccsc2)C2CC2)ccn1
InChIInChI=1S/C16H19N3OS/c1-2-17-15-9-13(5-7-18-15)16(20)19(14-3-4-14)10-12-6-8-21-11-12/h5-9,11,14H,2-4,10H2,1H3,(H,17,18)
InChIKeyCVFPAYWYMPCFOX-UHFFFAOYSA-N
MW301.42 g/mol
LogP3.38
Rot. Bonds6

About N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide

N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide (PubChem CID 62174755) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
PubChem CID62174755
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC NameN-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(Cc2ccsc2)C2CC2)ccn1
InChIInChI=1S/C16H19N3OS/c1-2-17-15-9-13(5-7-18-15)16(20)19(14-3-4-14)10-12-6-8-21-11-12/h5-9,11,14H,2-4,10H2,1H3,(H,17,18)
InChIKeyCVFPAYWYMPCFOX-UHFFFAOYSA-N
XLogP3.38
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-(dimethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
CID 51095237
N-cyclopropyl-3-[4-(methylamino)pyrimidin-2-yl]-N-(thiophen-3-ylmethyl)benzamide
CID 122565811
N-cyclobutyl-2-(ethylamino)-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 102685218
N-cyclopropyl-N-(thiophen-3-ylmethyl)-1,3-benzothiazole-6-carboxamide
CID 72717897
N-cyclopropyl-3-iodo-N-(thiophen-3-ylmethyl)benzamide
CID 61400460
N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
CID 62172696
N-cyclopropyl-3-fluoro-4-methoxy-N-(thiophen-3-ylmethyl)benzamide
CID 72717904
N-cyclopropyl-2,5-dimethyl-N-(thiophen-3-ylmethyl)benzamide
CID 51055390
2-(ethylamino)-N,N-dipropylpyridine-4-carboxamide
CID 62167745
4-[cyclopropyl-[(3,4-dimethylphenyl)methyl]carbamoyl]pyridine-2-carboxylic acid
CID 119186302
2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 55047494
N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 62242780

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide (CID 62174755) is N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide is CCNc1cc(C(=O)N(Cc2ccsc2)C2CC2)ccn1.
What is the InChIKey of N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide?
The InChIKey is CVFPAYWYMPCFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-2-17-15-9-13(5-7-18-15)16(20)19(14-3-4-14)10-12-6-8-21-11-12/h5-9,11,14H,2-4,10H2,1H3,(H,17,18).
What are the key properties of N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide?
N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide has a molecular weight of 301.42 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 62174755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).