2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide

C9H15N5OS — CID 62209102

IUPAC2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)Cc1nnsc1N
InChIInChI=1S/C9H15N5OS/c1-14(4-7-9(10)16-13-12-7)5-8(15)11-6-2-3-6/h6H,2-5,10H2,1H3,(H,11,15)
InChIKeyVUWWDFFYPQOOQW-UHFFFAOYSA-N
MW241.32 g/mol
LogP-0.17
Rot. Bonds5

About 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide

2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide (PubChem CID 62209102) has the molecular formula C9H15N5OS and a molecular weight of 241.32 g/mol. Its IUPAC name is 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide
PubChem CID62209102
Molecular FormulaC9H15N5OS
Molecular Weight241.32 g/mol
Exact Mass241.10
IUPAC Name2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)Cc1nnsc1N
InChIInChI=1S/C9H15N5OS/c1-14(4-7-9(10)16-13-12-7)5-8(15)11-6-2-3-6/h6H,2-5,10H2,1H3,(H,11,15)
InChIKeyVUWWDFFYPQOOQW-UHFFFAOYSA-N
XLogP-0.17
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-cyclopropylthiadiazole-4-carboxamide
CID 105441111
3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]propanamide
CID 60700103
N-cyclopropyl-2-[(3,6-dichloro-2-pyridinyl)methyl-methylamino]acetamide
CID 55127585
2-[(2-amino-4-pyridinyl)methyl-methylamino]-N-cyclopropylacetamide
CID 62464125
N-cyclopropyl-2-[(1-cyclopropyltetrazol-5-yl)methyl-methylamino]acetamide
CID 86922267
N-cyclopropyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide
CID 86919880
N-methyl-2-[methyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]acetamide
CID 62183804
2-[[2-(aminomethyl)phenyl]methyl-methylamino]-N-cyclopropylacetamide
CID 43575631
N-cyclopropyl-2-[[4-(2-hydrazinyl-2-oxoethyl)phenyl]methyl-methylamino]acetamide
CID 105351871
2-[(2-amino-6-chlorophenyl)methyl-methylamino]-N-cyclopropylacetamide
CID 55241095
N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 22196200
N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride
CID 86277381

Frequently Asked Questions

What is the IUPAC name of 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide (CID 62209102) is 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)Cc1nnsc1N.
What is the InChIKey of 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide?
The InChIKey is VUWWDFFYPQOOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5OS/c1-14(4-7-9(10)16-13-12-7)5-8(15)11-6-2-3-6/h6H,2-5,10H2,1H3,(H,11,15).
What are the key properties of 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide?
2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide has a molecular weight of 241.32 g/mol, XLogP of -0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-aminothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 62209102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).