3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide

C14H23N3OS — CID 119890065

IUPAC3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide
SMILESCc1nc(C(C)(C)NC(=O)C2CCC(N)C2)sc1C
InChIInChI=1S/C14H23N3OS/c1-8-9(2)19-13(16-8)14(3,4)17-12(18)10-5-6-11(15)7-10/h10-11H,5-7,15H2,1-4H3,(H,17,18)
InChIKeyCDQTVTBJMVAQKW-UHFFFAOYSA-N
MW281.43 g/mol
LogP2.24
Rot. Bonds3

About 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide

3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide (PubChem CID 119890065) has the molecular formula C14H23N3OS and a molecular weight of 281.43 g/mol. Its IUPAC name is 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide
PubChem CID119890065
Molecular FormulaC14H23N3OS
Molecular Weight281.43 g/mol
Exact Mass281.16
IUPAC Name3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide
SMILESCc1nc(C(C)(C)NC(=O)C2CCC(N)C2)sc1C
InChIInChI=1S/C14H23N3OS/c1-8-9(2)19-13(16-8)14(3,4)17-12(18)10-5-6-11(15)7-10/h10-11H,5-7,15H2,1-4H3,(H,17,18)
InChIKeyCDQTVTBJMVAQKW-UHFFFAOYSA-N
XLogP2.24
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.43
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide;dihydrochloride
CID 119890064
4-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673743
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]piperidine-3-carboxamide;dihydrochloride
CID 119890048
3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]propanamide;dihydrochloride
CID 119890095
3-amino-N-(2,4,4-trimethylpentan-2-yl)cyclopentane-1-carboxamide
CID 66009158
2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide
CID 56793632
3-amino-N-[(5-tert-butyl-1,3,4-thiadiazol-2-yl)methyl]cyclopentane-1-carboxamide
CID 119820909
3-amino-N-[2-(2-methoxyphenyl)propan-2-yl]cyclopentane-1-carboxamide
CID 119772802
2-[(3-aminocyclopentanecarbonyl)amino]-2-methylpentanoic acid
CID 66010443
2-[(4-aminocyclohexanecarbonyl)amino]-2-cyclopropylpropanoic acid
CID 61162345
3-amino-N-[5-(2-phenylpropan-2-yl)-1,3,4-thiadiazol-2-yl]cyclopentane-1-carboxamide
CID 119777248
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]-4-(methylamino)butanamide
CID 119890059

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide (CID 119890065) is 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide is Cc1nc(C(C)(C)NC(=O)C2CCC(N)C2)sc1C.
What is the InChIKey of 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide?
The InChIKey is CDQTVTBJMVAQKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3OS/c1-8-9(2)19-13(16-8)14(3,4)17-12(18)10-5-6-11(15)7-10/h10-11H,5-7,15H2,1-4H3,(H,17,18).
What are the key properties of 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide?
3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide has a molecular weight of 281.43 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119890065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).