N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine

C12H18N2S — CID 115886422

IUPACN-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine
SMILESCc1cnc(CNC2CC3CCC2C3)s1
InChIInChI=1S/C12H18N2S/c1-8-6-14-12(15-8)7-13-11-5-9-2-3-10(11)4-9/h6,9-11,13H,2-5,7H2,1H3
InChIKeyRTUYMBNIOACODM-UHFFFAOYSA-N
MW222.36 g/mol
LogP2.73
Rot. Bonds3

About N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine

N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine (PubChem CID 115886422) has the molecular formula C12H18N2S and a molecular weight of 222.36 g/mol. Its IUPAC name is N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound NameN-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine
PubChem CID115886422
Molecular FormulaC12H18N2S
Molecular Weight222.36 g/mol
Exact Mass222.12
IUPAC NameN-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine
SMILESCc1cnc(CNC2CC3CCC2C3)s1
InChIInChI=1S/C12H18N2S/c1-8-6-14-12(15-8)7-13-11-5-9-2-3-10(11)4-9/h6,9-11,13H,2-5,7H2,1H3
InChIKeyRTUYMBNIOACODM-UHFFFAOYSA-N
XLogP2.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bicyclo[2.2.1]heptanyl)-5-methyl-1,3-thiazol-2-amine
CID 131209075
N-[(4-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 61309763
N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclopropanamine;dihydrochloride
CID 56773659
N-[(5-methyl-1,3-thiazol-2-yl)methyl]cycloheptanamine
CID 115655830
2,6-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclohexan-1-amine
CID 115724485
2-ethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclopentan-1-amine
CID 115724522
N-(1,3-benzothiazol-2-ylmethyl)bicyclo[2.2.1]heptan-2-amine
CID 61309719
1,2,5-trimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 103786303
N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxetan-3-amine
CID 103874822
1-ethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 115724500
(1R,2R,4R)-N-(pyridin-2-ylmethyl)bicyclo[2.2.1]heptan-2-amine
CID 98119416
1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 103786250

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine (CID 115886422) is N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine is Cc1cnc(CNC2CC3CCC2C3)s1.
What is the InChIKey of N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
The InChIKey is RTUYMBNIOACODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2S/c1-8-6-14-12(15-8)7-13-11-5-9-2-3-10(11)4-9/h6,9-11,13H,2-5,7H2,1H3.
What are the key properties of N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine?
N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine has a molecular weight of 222.36 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 115886422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).