tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate

C16H25N3O2 — CID 133482310

IUPACtert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate
SMILESCc1cccc(N2CCCC(NC(=O)OC(C)(C)C)C2)n1
InChIInChI=1S/C16H25N3O2/c1-12-7-5-9-14(17-12)19-10-6-8-13(11-19)18-15(20)21-16(2,3)4/h5,7,9,13H,6,8,10-11H2,1-4H3,(H,18,20)
InChIKeyOCPYFLLOIRXQGN-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.88
Rot. Bonds2

About tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate

tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate (PubChem CID 133482310) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate
PubChem CID133482310
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Nametert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate
SMILESCc1cccc(N2CCCC(NC(=O)OC(C)(C)C)C2)n1
InChIInChI=1S/C16H25N3O2/c1-12-7-5-9-14(17-12)19-10-6-8-13(11-19)18-15(20)21-16(2,3)4/h5,7,9,13H,6,8,10-11H2,1-4H3,(H,18,20)
InChIKeyOCPYFLLOIRXQGN-UHFFFAOYSA-N
XLogP2.88
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate 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

tert-butyl N-[(3S)-1-(6-bromo-2-pyridinyl)piperidin-3-yl]carbamate
CID 86318359
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191
tert-butyl N-[(3S)-1-(2-methylsulfanylpyrimidin-4-yl)piperidin-3-yl]carbamate
CID 86329125
tert-butyl N-[(3S)-1-[6-(6-chloropyrazolo[4,3-c]pyridin-1-yl)-2-pyridinyl]piperidin-3-yl]carbamate
CID 86707103
tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate
CID 91811841
2-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]pyridine-4-carboxylic acid
CID 95735597
tert-butyl N-[1-(6-methylpyrazin-2-yl)pyrrolidin-3-yl]carbamate
CID 133470611
tert-butyl N-[(3S)-1-(5-bromo-4-methyl-2-pyridinyl)piperidin-3-yl]carbamate
CID 169408080
tert-butyl N-[(3R)-1-(5-bromo-4-methyl-2-pyridinyl)piperidin-3-yl]carbamate
CID 169408081
tert-butyl N-[(3S)-1-(5-iodopyrimidin-2-yl)piperidin-3-yl]carbamate
CID 171390444
tert-butyl N-[1-(6-tert-butylpyrimidin-4-yl)piperidin-3-yl]carbamate
CID 126849999
2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide
CID 125023608

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate?
The IUPAC name of tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate (CID 133482310) is tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate.
What is the SMILES notation for tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate?
The canonical SMILES for tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate is Cc1cccc(N2CCCC(NC(=O)OC(C)(C)C)C2)n1.
What is the InChIKey of tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate?
The InChIKey is OCPYFLLOIRXQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12-7-5-9-14(17-12)19-10-6-8-13(11-19)18-15(20)21-16(2,3)4/h5,7,9,13H,6,8,10-11H2,1-4H3,(H,18,20).
What are the key properties of tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate?
tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate has a molecular weight of 291.39 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate is sourced from PubChem (CID 133482310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).