N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide

C15H24N4O2 — CID 166600760

IUPACN-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide
SMILESCOc1ccnc(N2CCCC(C(=O)NC(C)(C)C)C2)n1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)18-13(20)11-6-5-9-19(10-11)14-16-8-7-12(17-14)21-4/h7-8,11H,5-6,9-10H2,1-4H3,(H,18,20)
InChIKeyORBINSSDTMZABM-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.62
Rot. Bonds3

About N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide

N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide (PubChem CID 166600760) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide
PubChem CID166600760
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide
SMILESCOc1ccnc(N2CCCC(C(=O)NC(C)(C)C)C2)n1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)18-13(20)11-6-5-9-19(10-11)14-16-8-7-12(17-14)21-4/h7-8,11H,5-6,9-10H2,1-4H3,(H,18,20)
InChIKeyORBINSSDTMZABM-UHFFFAOYSA-N
XLogP1.62
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-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

(3R)-N-tert-butyl-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide
CID 1452556
(3S)-N-(5-chloro-2-pyridinyl)-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide
CID 124880924
tert-butyl N-[(3R)-1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]carbamate
CID 97007663
N-tert-butyl-1-(3-methoxy-2-pyridinyl)piperidine-3-carboxamide
CID 172880737
2-[1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]acetic acid
CID 55104995
2-(3-fluoropiperidin-1-yl)-4-methoxypyrimidine
CID 171701610
4-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyrimidine
CID 126817206
N-tert-butyl-1-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide
CID 166606098
N-tert-butyl-1-(2-methoxy-4-pyridinyl)azetidine-3-carboxamide
CID 166602186
N-[5-[(3R)-1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
CID 97343986
1-[(3R)-1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]pyrrolidin-2-one
CID 95557149
(2S)-1-(4-methoxypyrimidin-2-yl)pyrrolidine-2-carboxylic acid
CID 93274420

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide?
The IUPAC name of N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide (CID 166600760) is N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide?
The canonical SMILES for N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide is COc1ccnc(N2CCCC(C(=O)NC(C)(C)C)C2)n1.
What is the InChIKey of N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide?
The InChIKey is ORBINSSDTMZABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-15(2,3)18-13(20)11-6-5-9-19(10-11)14-16-8-7-12(17-14)21-4/h7-8,11H,5-6,9-10H2,1-4H3,(H,18,20).
What are the key properties of N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide?
N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 166600760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).