N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine

C16H24N2S — CID 104584992

IUPACN-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine
SMILESCC(CNC1C2CC3CC(C2)CC1C3)c1nccs1
InChIInChI=1S/C16H24N2S/c1-10(16-17-2-3-19-16)9-18-15-13-5-11-4-12(7-13)8-14(15)6-11/h2-3,10-15,18H,4-9H2,1H3
InChIKeyPICLEXCBAAERFD-UHFFFAOYSA-N
MW276.45 g/mol
LogP3.66
Rot. Bonds4

About N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine

N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine (PubChem CID 104584992) has the molecular formula C16H24N2S and a molecular weight of 276.45 g/mol. Its IUPAC name is N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine.

Molecular Properties

Compound NameN-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine
PubChem CID104584992
Molecular FormulaC16H24N2S
Molecular Weight276.45 g/mol
Exact Mass276.17
IUPAC NameN-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine
SMILESCC(CNC1C2CC3CC(C2)CC1C3)c1nccs1
InChIInChI=1S/C16H24N2S/c1-10(16-17-2-3-19-16)9-18-15-13-5-11-4-12(7-13)8-14(15)6-11/h2-3,10-15,18H,4-9H2,1H3
InChIKeyPICLEXCBAAERFD-UHFFFAOYSA-N
XLogP3.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(1,3-thiazol-2-yl)propyl]adamantan-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-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-2-amine
CID 104585038
(6S)-6-methyl-N-[2-(1,3-thiazol-2-yl)propyl]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-amine
CID 104585069
1-cyclopropyl-N-[2-(1,3-thiazol-2-yl)propyl]propan-2-amine
CID 104584982
5-fluoro-N-[2-(1,3-thiazol-2-yl)propyl]-2,3-dihydro-1H-inden-1-amine
CID 104584945
N-[2-(1,3-thiazol-2-yl)propyl]pyrimidin-2-amine
CID 104577139
4-[2-(1,3-thiazol-2-yl)propylamino]piperidine-1-carboxamide
CID 104584924
2-methyl-N-[2-(1,3-thiazol-2-yl)propyl]propanamide
CID 104578837
2-(1-iodoethyl)-1,3-thiazole
CID 89231680
4-hydroxy-N-[2-(1,3-thiazol-2-yl)propyl]pyrrolidine-2-carboxamide
CID 114127532
2-(1-bromopropan-2-yl)-1,3-thiazole
CID 66470662
N-[1-(1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexan-3-amine
CID 130941268
N-[[5-(aminomethyl)oxolan-2-yl]methyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 114128154

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine?
The IUPAC name of N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine (CID 104584992) is N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine.
What is the SMILES notation for N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine?
The canonical SMILES for N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine is CC(CNC1C2CC3CC(C2)CC1C3)c1nccs1.
What is the InChIKey of N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine?
The InChIKey is PICLEXCBAAERFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2S/c1-10(16-17-2-3-19-16)9-18-15-13-5-11-4-12(7-13)8-14(15)6-11/h2-3,10-15,18H,4-9H2,1H3.
What are the key properties of N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine?
N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine has a molecular weight of 276.45 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazol-2-yl)propyl]adamantan-2-amine is sourced from PubChem (CID 104584992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).