1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine

C16H29N3S — CID 61335805

IUPAC1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine
SMILESCCN1CCC(NC(C)C)(c2nc(C(C)C)cs2)CC1
InChIInChI=1S/C16H29N3S/c1-6-19-9-7-16(8-10-19,18-13(4)5)15-17-14(11-20-15)12(2)3/h11-13,18H,6-10H2,1-5H3
InChIKeyHRZCTXPVVYLQSU-UHFFFAOYSA-N
MW295.50 g/mol
LogP3.58
Rot. Bonds5

About 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine

1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine (PubChem CID 61335805) has the molecular formula C16H29N3S and a molecular weight of 295.50 g/mol. Its IUPAC name is 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine
PubChem CID61335805
Molecular FormulaC16H29N3S
Molecular Weight295.50 g/mol
Exact Mass295.21
IUPAC Name1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine
SMILESCCN1CCC(NC(C)C)(c2nc(C(C)C)cs2)CC1
InChIInChI=1S/C16H29N3S/c1-6-19-9-7-16(8-10-19,18-13(4)5)15-17-14(11-20-15)12(2)3/h11-13,18H,6-10H2,1-5H3
InChIKeyHRZCTXPVVYLQSU-UHFFFAOYSA-N
XLogP3.58
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.50
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
The IUPAC name of 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine (CID 61335805) is 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine is CCN1CCC(NC(C)C)(c2nc(C(C)C)cs2)CC1.
What is the InChIKey of 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
The InChIKey is HRZCTXPVVYLQSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3S/c1-6-19-9-7-16(8-10-19,18-13(4)5)15-17-14(11-20-15)12(2)3/h11-13,18H,6-10H2,1-5H3.
What are the key properties of 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine has a molecular weight of 295.50 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine is sourced from PubChem (CID 61335805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).