2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide

C10H15N3OS — CID 66373599

IUPAC2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide
SMILESCC(N)c1nc(C(=O)NCC2CC2)cs1
InChIInChI=1S/C10H15N3OS/c1-6(11)10-13-8(5-15-10)9(14)12-4-7-2-3-7/h5-7H,2-4,11H2,1H3,(H,12,14)
InChIKeyHNANRIKMMJPXQV-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.30
Rot. Bonds4

About 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide

2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide (PubChem CID 66373599) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide
PubChem CID66373599
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide
SMILESCC(N)c1nc(C(=O)NCC2CC2)cs1
InChIInChI=1S/C10H15N3OS/c1-6(11)10-13-8(5-15-10)9(14)12-4-7-2-3-7/h5-7H,2-4,11H2,1H3,(H,12,14)
InChIKeyHNANRIKMMJPXQV-UHFFFAOYSA-N
XLogP1.30
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-aminoethyl)-N-(oxan-4-ylmethyl)-1,3-thiazole-4-carboxamide
CID 66388405
2-[[[2-(1-aminoethyl)-1,3-thiazole-4-carbonyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 66390159
2-(1-aminoethyl)-N-[(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)methyl]-1,3-thiazole-4-carboxamide
CID 3762756
2-(1-aminoethyl)-N-hydroxy-1,3-thiazole-4-carboxamide
CID 66389377
2-(1-aminoethyl)-N-(1,4-dioxan-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 66388723
N-[[1-[2-(1-aminoethyl)-1,3-thiazole-4-carbonyl]piperidin-4-yl]methyl]acetamide
CID 102736248
2-(1-aminoethyl)-N-butan-2-yl-1,3-thiazole-4-carboxamide
CID 66374745
2-(1-aminoethyl)-N-(1-hydroxypropan-2-yl)-1,3-thiazole-4-carboxamide
CID 66375369
2-(1-aminoethyl)-N-(3-propoxypropyl)-1,3-thiazole-4-carboxamide
CID 82939939
2-(1-aminoethyl)-N-[2-(dimethylamino)-3-ethylpentyl]-1,3-thiazole-4-carboxamide
CID 66388934
2-(aminomethyl)-N-(cyclooctylmethyl)-1,3-thiazole-4-carboxamide
CID 119741882
2-amino-N-[(4-methylcyclohexyl)methyl]-1,3-thiazole-4-carboxamide
CID 63243415

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide (CID 66373599) is 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide is CC(N)c1nc(C(=O)NCC2CC2)cs1.
What is the InChIKey of 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is HNANRIKMMJPXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-6(11)10-13-8(5-15-10)9(14)12-4-7-2-3-7/h5-7H,2-4,11H2,1H3,(H,12,14).
What are the key properties of 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide?
2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminoethyl)-N-(cyclopropylmethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 66373599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).