tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate

C15H24N4O2 — CID 91811841

IUPACtert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate
SMILESCC(C)(C)OC(=O)NC1CCCN(c2cc(N)ccn2)C1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-12-5-4-8-19(10-12)13-9-11(16)6-7-17-13/h6-7,9,12H,4-5,8,10H2,1-3H3,(H2,16,17)(H,18,20)
InChIKeyZUOGFBZXWBJSRD-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.16
Rot. Bonds2

About tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate

tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate (PubChem CID 91811841) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate
PubChem CID91811841
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Nametert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate
SMILESCC(C)(C)OC(=O)NC1CCCN(c2cc(N)ccn2)C1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-12-5-4-8-19(10-12)13-9-11(16)6-7-17-13/h6-7,9,12H,4-5,8,10H2,1-3H3,(H2,16,17)(H,18,20)
InChIKeyZUOGFBZXWBJSRD-UHFFFAOYSA-N
XLogP2.16
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]pyridine-4-carboxylic acid
CID 95735597
tert-butyl N-[1-(4-methyl-2-pyridinyl)pyrrolidin-3-yl]carbamate
CID 18667607
tert-butyl N-[1-(6-tert-butylpyrimidin-4-yl)piperidin-3-yl]carbamate
CID 126849999
tert-butyl N-[(3S)-1-(2-methylsulfanylpyrimidin-4-yl)piperidin-3-yl]carbamate
CID 86329125
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-[(3R)-1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-yl]carbamate
CID 86331531
tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate
CID 133482310
tert-butyl N-[(3S)-1-[4-amino-2-(trifluoromethyl)phenyl]piperidin-3-yl]carbamate
CID 91506279
tert-butyl N-[1-[3-amino-2-(methylamino)-4-pyridinyl]piperidin-3-yl]carbamate
CID 77473382
tert-butyl N-[1-[6-(difluoromethyl)pyrimidin-4-yl]piperidin-3-yl]carbamate
CID 126850026
tert-butyl N-[1-(2-amino-6-oxo-1H-pyrimidin-4-yl)piperidin-3-yl]carbamate
CID 137310018

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate?
The IUPAC name of tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate (CID 91811841) is tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate.
What is the SMILES notation for tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate?
The canonical SMILES for tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate is CC(C)(C)OC(=O)NC1CCCN(c2cc(N)ccn2)C1.
What is the InChIKey of tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate?
The InChIKey is ZUOGFBZXWBJSRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-12-5-4-8-19(10-12)13-9-11(16)6-7-17-13/h6-7,9,12H,4-5,8,10H2,1-3H3,(H2,16,17)(H,18,20).
What are the key properties of tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate?
tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate has a molecular weight of 292.38 g/mol, XLogP of 2.16, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-(4-amino-2-pyridinyl)piperidin-3-yl]carbamate is sourced from PubChem (CID 91811841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).