N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine

C14H25N3S — CID 114132011

IUPACN-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
SMILESCCC1CCNC(CNC(C)(C)c2nccs2)C1
InChIInChI=1S/C14H25N3S/c1-4-11-5-6-15-12(9-11)10-17-14(2,3)13-16-7-8-18-13/h7-8,11-12,15,17H,4-6,9-10H2,1-3H3
InChIKeyARTZQLKWUSYZCU-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.75
Rot. Bonds5

About N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine

N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine (PubChem CID 114132011) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
PubChem CID114132011
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC NameN-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
SMILESCCC1CCNC(CNC(C)(C)c2nccs2)C1
InChIInChI=1S/C14H25N3S/c1-4-11-5-6-15-12(9-11)10-17-14(2,3)13-16-7-8-18-13/h7-8,11-12,15,17H,4-6,9-10H2,1-3H3
InChIKeyARTZQLKWUSYZCU-UHFFFAOYSA-N
XLogP2.75
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-piperidin-2-ylpropyl)-2-(1,3-thiazol-2-yl)propan-2-amine
CID 114132023
1-(4-ethylpiperidin-2-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 114431418
N-[(4-ethylpiperidin-2-yl)methyl]cyclopropanamine
CID 114430809
N-[(4-ethylpiperidin-2-yl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 106052624
4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine
CID 114426164
N-ethyl-4-[[2-(1,3-thiazol-2-yl)propan-2-ylamino]methyl]oxolan-3-amine
CID 114132035
2-[2-(3-ethyl-1,4-diazepan-1-yl)propan-2-yl]-1,3-thiazole
CID 114129910
N-[(5-chlorofuran-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 115630853
N-[(4-methylpiperidin-2-yl)methyl]-1-(1,3-thiazol-2-yl)propan-1-amine
CID 114421565
N-[(4-ethylpiperidin-2-yl)methyl]-2-methylpropan-1-amine
CID 114430810
3-methyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]cyclohexan-1-amine
CID 115907245
2-pyrrolidin-2-yl-N-[2-(1,3-thiazol-2-yl)butan-2-yl]acetamide;dihydrochloride
CID 119892436

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine?
The IUPAC name of N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine (CID 114132011) is N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine.
What is the SMILES notation for N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine?
The canonical SMILES for N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine is CCC1CCNC(CNC(C)(C)c2nccs2)C1.
What is the InChIKey of N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine?
The InChIKey is ARTZQLKWUSYZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-4-11-5-6-15-12(9-11)10-17-14(2,3)13-16-7-8-18-13/h7-8,11-12,15,17H,4-6,9-10H2,1-3H3.
What are the key properties of N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine?
N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine has a molecular weight of 267.44 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine is sourced from PubChem (CID 114132011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).