N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine

C12H20N2OS — CID 64542086

IUPACN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine
SMILESCOC1CCCC1NCc1sc(C)nc1C
InChIInChI=1S/C12H20N2OS/c1-8-12(16-9(2)14-8)7-13-10-5-4-6-11(10)15-3/h10-11,13H,4-7H2,1-3H3
InChIKeyYCUYHRCYDACYEQ-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.42
Rot. Bonds4

About N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine

N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine (PubChem CID 64542086) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine.

Molecular Properties

Compound NameN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine
PubChem CID64542086
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine
SMILESCOC1CCCC1NCc1sc(C)nc1C
InChIInChI=1S/C12H20N2OS/c1-8-12(16-9(2)14-8)7-13-10-5-4-6-11(10)15-3/h10-11,13H,4-7H2,1-3H3
InChIKeyYCUYHRCYDACYEQ-UHFFFAOYSA-N
XLogP2.42
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,5-dimethylthiophen-3-yl)methyl]-2-methoxycyclopentan-1-amine
CID 62087491
2-methoxy-N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]cyclopentan-1-amine
CID 82893823
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]thietan-3-amine
CID 130616420
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-(4-methylcyclohexyl)methanamine
CID 64540574
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-phenylcyclopropan-1-amine
CID 64540999
N-ethyl-2-methoxycyclopentan-1-amine
CID 53276122
N-[(4,5-dibromothiophen-2-yl)methyl]-2-methoxycyclopentan-1-amine
CID 102835320
2-methoxy-N-[(5-methyl-1H-imidazol-4-yl)methyl]cyclopentan-1-amine
CID 62741204
N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-2-methoxycyclopentan-1-amine
CID 62086943
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide
CID 121122773
N-[(6-bromo-2-pyridinyl)methyl]-2-methoxycyclopentan-1-amine
CID 112582298
2-methoxy-N-[(4-methylphenyl)methyl]cyclohexan-1-amine
CID 43765239

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine?
The IUPAC name of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine (CID 64542086) is N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine.
What is the SMILES notation for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine?
The canonical SMILES for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine is COC1CCCC1NCc1sc(C)nc1C.
What is the InChIKey of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine?
The InChIKey is YCUYHRCYDACYEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-8-12(16-9(2)14-8)7-13-10-5-4-6-11(10)15-3/h10-11,13H,4-7H2,1-3H3.
What are the key properties of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine?
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine has a molecular weight of 240.37 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-2-methoxycyclopentan-1-amine is sourced from PubChem (CID 64542086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).