1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide

C13H19N3OS — CID 54959029

IUPAC1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)Nc2nc(C3CC3)cs2)CCCCC1
InChIInChI=1S/C13H19N3OS/c14-13(6-2-1-3-7-13)11(17)16-12-15-10(8-18-12)9-4-5-9/h8-9H,1-7,14H2,(H,15,16,17)
InChIKeyRNLXGCOUNYKOGV-UHFFFAOYSA-N
MW265.38 g/mol
LogP2.62
Rot. Bonds3

About 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide

1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide (PubChem CID 54959029) has the molecular formula C13H19N3OS and a molecular weight of 265.38 g/mol. Its IUPAC name is 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
PubChem CID54959029
Molecular FormulaC13H19N3OS
Molecular Weight265.38 g/mol
Exact Mass265.12
IUPAC Name1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)Nc2nc(C3CC3)cs2)CCCCC1
InChIInChI=1S/C13H19N3OS/c14-13(6-2-1-3-7-13)11(17)16-12-15-10(8-18-12)9-4-5-9/h8-9H,1-7,14H2,(H,15,16,17)
InChIKeyRNLXGCOUNYKOGV-UHFFFAOYSA-N
XLogP2.62
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclobutane-1-carboxamide
CID 115448467
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-1-methylcyclopentane-1-carboxamide
CID 82767511
4-(aminomethyl)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxane-4-carboxamide
CID 115439495
1-(4-aminophenyl)-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 115913567
1-amino-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]cyclopentane-1-carboxamide
CID 119266416
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-ethylpiperidine-4-carboxamide
CID 63129094
1-amino-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]cyclohexane-1-carboxamide
CID 120606542
(1S)-2,2-dichloro-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 33302453
1-amino-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]cyclohexane-1-carboxamide
CID 119830558
2-[1-[(4-cyclopropyl-1,3-thiazol-2-yl)carbamoylamino]cyclopentyl]acetic acid
CID 64700681
1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119292978

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide (CID 54959029) is 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide is NC1(C(=O)Nc2nc(C3CC3)cs2)CCCCC1.
What is the InChIKey of 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide?
The InChIKey is RNLXGCOUNYKOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3OS/c14-13(6-2-1-3-7-13)11(17)16-12-15-10(8-18-12)9-4-5-9/h8-9H,1-7,14H2,(H,15,16,17).
What are the key properties of 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide?
1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide has a molecular weight of 265.38 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 54959029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).