2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine

C11H18N2OS — CID 115732649

IUPAC2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
SMILESCOC1CCCCC1NCc1cncs1
InChIInChI=1S/C11H18N2OS/c1-14-11-5-3-2-4-10(11)13-7-9-6-12-8-15-9/h6,8,10-11,13H,2-5,7H2,1H3
InChIKeyQJRDYBNLOANTCH-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.19
Rot. Bonds4

About 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine

2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine (PubChem CID 115732649) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
PubChem CID115732649
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
SMILESCOC1CCCCC1NCc1cncs1
InChIInChI=1S/C11H18N2OS/c1-14-11-5-3-2-4-10(11)13-7-9-6-12-8-15-9/h6,8,10-11,13H,2-5,7H2,1H3
InChIKeyQJRDYBNLOANTCH-UHFFFAOYSA-N
XLogP2.19
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,3-thiazol-5-ylmethylamino)cyclohexan-1-ol
CID 62758912
2-N-(1,3-thiazol-5-ylmethyl)cyclohexane-1,2-diamine
CID 71644176
2-ethyl-N-(1,3-thiazol-5-ylmethyl)cyclopentan-1-amine
CID 115732788
(2R,3R)-2-methyl-N-(1,3-thiazol-5-ylmethyl)oxolan-3-amine
CID 130933670
2-methoxy-N-[(3-propan-2-ylimidazol-4-yl)methyl]cyclopentan-1-amine
CID 66164359
N-[(4,5-dibromothiophen-2-yl)methyl]-2-methoxycyclopentan-1-amine
CID 102835320
2,4,4-trimethyl-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
CID 115732727
2-methoxy-N-[(4-methylphenyl)methyl]cyclohexan-1-amine
CID 43765239
N-[(5-chlorofuran-2-yl)methyl]-2-methoxycyclohexan-1-amine
CID 115655856
2-methoxy-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]cyclopentan-1-amine
CID 62901090
trans-(1S,2S)-N-ethyl-2-methoxycyclohexan-1-amine
CID 93280859
5-[[(2-methoxycyclopentyl)amino]methyl]thiophene-2-carboxylic acid
CID 103248527

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine (CID 115732649) is 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine is COC1CCCCC1NCc1cncs1.
What is the InChIKey of 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
The InChIKey is QJRDYBNLOANTCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-14-11-5-3-2-4-10(11)13-7-9-6-12-8-15-9/h6,8,10-11,13H,2-5,7H2,1H3.
What are the key properties of 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine has a molecular weight of 226.34 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 115732649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).