5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine

C13H21N3OS — CID 120903931

IUPAC5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
SMILESNc1ncc(CN2CCC(OCC3CC3)CC2)s1
InChIInChI=1S/C13H21N3OS/c14-13-15-7-12(18-13)8-16-5-3-11(4-6-16)17-9-10-1-2-10/h7,10-11H,1-6,8-9H2,(H2,14,15)
InChIKeyOKEWRJPLUJPIBO-UHFFFAOYSA-N
MW267.40 g/mol
LogP2.12
Rot. Bonds5

About 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine

5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine (PubChem CID 120903931) has the molecular formula C13H21N3OS and a molecular weight of 267.40 g/mol. Its IUPAC name is 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
PubChem CID120903931
Molecular FormulaC13H21N3OS
Molecular Weight267.40 g/mol
Exact Mass267.14
IUPAC Name5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
SMILESNc1ncc(CN2CCC(OCC3CC3)CC2)s1
InChIInChI=1S/C13H21N3OS/c14-13-15-7-12(18-13)8-16-5-3-11(4-6-16)17-9-10-1-2-10/h7,10-11H,1-6,8-9H2,(H2,14,15)
InChIKeyOKEWRJPLUJPIBO-UHFFFAOYSA-N
XLogP2.12
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-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

5-[(4-cyclopentyloxypiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 120899557
5-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 79771816
5-[[4-[(3,4-dichlorophenyl)methoxy]piperidin-1-yl]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120904110
5-[[4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]oxypiperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 25258494
5-[[4-(4-methylphenoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120898672
5-[(4-tert-butylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120899501
[1-[(2-amino-1,3-thiazol-5-yl)methyl]pyrrolidin-3-yl]methanol;hydrochloride
CID 120899572
5-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120898110
5-[(4-propylazepan-1-yl)methyl]-1,3-thiazol-2-amine
CID 79772441
5-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazol-2-amine
CID 82171608
5-[(4,4-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120903163
5-[[4-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 120903108

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine (CID 120903931) is 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine is Nc1ncc(CN2CCC(OCC3CC3)CC2)s1.
What is the InChIKey of 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine?
The InChIKey is OKEWRJPLUJPIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OS/c14-13-15-7-12(18-13)8-16-5-3-11(4-6-16)17-9-10-1-2-10/h7,10-11H,1-6,8-9H2,(H2,14,15).
What are the key properties of 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine?
5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine has a molecular weight of 267.40 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(cyclopropylmethoxy)piperidin-1-yl]methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 120903931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).