N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide

C15H26N4OS — CID 106626410

IUPACN-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide
SMILESCC(C)c1nnsc1C(=O)N(CC1CCCCN1)C(C)C
InChIInChI=1S/C15H26N4OS/c1-10(2)13-14(21-18-17-13)15(20)19(11(3)4)9-12-7-5-6-8-16-12/h10-12,16H,5-9H2,1-4H3
InChIKeyKAKSMBVFQPETGE-UHFFFAOYSA-N
MW310.47 g/mol
LogP2.65
Rot. Bonds5

About N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide

N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide (PubChem CID 106626410) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide
PubChem CID106626410
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC NameN-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide
SMILESCC(C)c1nnsc1C(=O)N(CC1CCCCN1)C(C)C
InChIInChI=1S/C15H26N4OS/c1-10(2)13-14(21-18-17-13)15(20)19(11(3)4)9-12-7-5-6-8-16-12/h10-12,16H,5-9H2,1-4H3
InChIKeyKAKSMBVFQPETGE-UHFFFAOYSA-N
XLogP2.65
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide 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-methyl-N-(piperidin-2-ylmethyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 106627200
4-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylthiadiazole-5-carboxamide
CID 106626701
N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2-oxazole-3-carboxamide
CID 106626378
3,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylbenzamide
CID 106626473
5-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2-oxazole-3-carboxamide
CID 106626603
2,6-dichloro-N-(piperidin-2-ylmethyl)-N-propan-2-ylbenzamide
CID 106626462
N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide
CID 106626170
3-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylimidazole-4-carboxamide
CID 106626597
N-(piperidin-2-ylmethyl)-N-propan-2-ylthieno[3,2-b]thiophene-5-carboxamide
CID 106626552
N-(3-hydroxypropyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide
CID 65204482
N-(piperidin-2-ylmethyl)-N-propan-2-ylbut-2-ynamide
CID 107990956
3-methyl-1-(piperidin-2-ylmethyl)-1-propan-2-ylurea
CID 106629717

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide?
The IUPAC name of N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide (CID 106626410) is N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide is CC(C)c1nnsc1C(=O)N(CC1CCCCN1)C(C)C.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide?
The InChIKey is KAKSMBVFQPETGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-10(2)13-14(21-18-17-13)15(20)19(11(3)4)9-12-7-5-6-8-16-12/h10-12,16H,5-9H2,1-4H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide?
N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide has a molecular weight of 310.47 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N,4-di(propan-2-yl)thiadiazole-5-carboxamide is sourced from PubChem (CID 106626410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).