N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide

C14H17N3OS — CID 61293337

IUPACN-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide
SMILESCc1cc(NC(=O)CCCc2cccs2)ncc1N
InChIInChI=1S/C14H17N3OS/c1-10-8-13(16-9-12(10)15)17-14(18)6-2-4-11-5-3-7-19-11/h3,5,7-9H,2,4,6,15H2,1H3,(H,16,17,18)
InChIKeyCWKUSKWNTUKUSK-UHFFFAOYSA-N
MW275.38 g/mol
LogP3.00
Rot. Bonds5

About N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide

N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide (PubChem CID 61293337) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide.

Molecular Properties

Compound NameN-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide
PubChem CID61293337
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC NameN-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide
SMILESCc1cc(NC(=O)CCCc2cccs2)ncc1N
InChIInChI=1S/C14H17N3OS/c1-10-8-13(16-9-12(10)15)17-14(18)6-2-4-11-5-3-7-19-11/h3,5,7-9H,2,4,6,15H2,1H3,(H,16,17,18)
InChIKeyCWKUSKWNTUKUSK-UHFFFAOYSA-N
XLogP3.00
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-5-thiophen-2-ylpentanamide
CID 5234627
N-(2-bromo-5-methylphenyl)-4-thiophen-2-ylbutanamide
CID 82707214
N-(4-amino-3-chlorophenyl)-4-thiophen-2-ylbutanamide
CID 82862241
N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-thiophen-2-ylbutanamide
CID 18079690
N-(4-methyl-2-pyridinyl)-3-(4-thiophen-2-ylbutanoylamino)benzamide
CID 52723788
4-thiophen-2-yl-N-(1H-1,2,4-triazol-5-yl)butanamide
CID 30866887
N-[(5S)-5-methyl-4,5-dihydro-1,2-oxazol-3-yl]-4-thiophen-2-ylbutanamide
CID 125136014
ethyl 2-(4-thiophen-2-ylbutanoylamino)propanoate
CID 61343312
N-(1,3-dimethylpyrazol-4-yl)-4-thiophen-2-ylbutanamide
CID 134698261
N-(3-methyl-2-pyridinyl)-3-(4-thiophen-2-ylbutanoylamino)benzamide
CID 52723792
5-thiophen-2-ylpentanehydrazide
CID 70194284
N-(3-iodophenyl)-4-thiophen-2-ylbutanamide
CID 7688853

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide?
The IUPAC name of N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide (CID 61293337) is N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide.
What is the SMILES notation for N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide?
The canonical SMILES for N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide is Cc1cc(NC(=O)CCCc2cccs2)ncc1N.
What is the InChIKey of N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide?
The InChIKey is CWKUSKWNTUKUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-10-8-13(16-9-12(10)15)17-14(18)6-2-4-11-5-3-7-19-11/h3,5,7-9H,2,4,6,15H2,1H3,(H,16,17,18).
What are the key properties of N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide?
N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide has a molecular weight of 275.38 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-4-methyl-2-pyridinyl)-4-thiophen-2-ylbutanamide is sourced from PubChem (CID 61293337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).