6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate

C17H28N4O3 — CID 174638933

IUPAC6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate
SMILESCC(C)(C)OC=O.CN(C(=O)c1ccc(N)nc1)C1CCNCC1
InChIInChI=1S/C12H18N4O.C5H10O2/c1-16(10-4-6-14-7-5-10)12(17)9-2-3-11(13)15-8-9;1-5(2,3)7-4-6/h2-3,8,10,14H,4-7H2,1H3,(H2,13,15);4H,1-3H3
InChIKeyYIZNAPLPAHNNFJ-UHFFFAOYSA-N
MW336.44 g/mol
LogP1.45
Rot. Bonds3

About 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate

6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate (PubChem CID 174638933) has the molecular formula C17H28N4O3 and a molecular weight of 336.44 g/mol. Its IUPAC name is 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate.

Molecular Properties

Compound Name6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate
PubChem CID174638933
Molecular FormulaC17H28N4O3
Molecular Weight336.44 g/mol
Exact Mass336.22
IUPAC Name6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate
SMILESCC(C)(C)OC=O.CN(C(=O)c1ccc(N)nc1)C1CCNCC1
InChIInChI=1S/C12H18N4O.C5H10O2/c1-16(10-4-6-14-7-5-10)12(17)9-2-3-11(13)15-8-9;1-5(2,3)7-4-6/h2-3,8,10,14H,4-7H2,1H3,(H2,13,15);4H,1-3H3
InChIKeyYIZNAPLPAHNNFJ-UHFFFAOYSA-N
XLogP1.45
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-methyl-N-(oxan-4-yl)pyridine-3-carboxamide
CID 62156515
(6-bromo-3-pyridinyl)-piperidin-4-ylmethanone;tert-butyl formate
CID 175122441
1-N-(2-aminopyrimidin-5-yl)-4-N-methyl-4-N-piperidin-4-ylbenzene-1,4-dicarboxamide
CID 162705843
6-(4-bromophenoxy)-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;dihydrochloride
CID 119441262
4-[(4-tert-butylphenoxy)methyl]-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119441295
4-isocyano-N-methyl-N-piperidin-4-ylbenzamide
CID 140732667
tert-butyl formate;(4-chlorophenyl)-piperidin-4-ylmethanone
CID 175329360
tert-butyl formate;4-tert-butyl-N-(piperidin-4-ylmethyl)benzamide
CID 174760700
N-methyl-N-piperidin-4-yl-3,4-dipropoxybenzamide
CID 119443973
N-(azepan-4-yl)-4-bromo-N-methylbenzamide
CID 104974446
N-cyclopropyl-N-methyl-4-piperidin-4-yloxybenzamide
CID 143792433
N-methyl-6-pyrrolidin-1-yl-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119550921

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate?
The IUPAC name of 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate (CID 174638933) is 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate.
What is the SMILES notation for 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate?
The canonical SMILES for 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate is CC(C)(C)OC=O.CN(C(=O)c1ccc(N)nc1)C1CCNCC1.
What is the InChIKey of 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate?
The InChIKey is YIZNAPLPAHNNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O.C5H10O2/c1-16(10-4-6-14-7-5-10)12(17)9-2-3-11(13)15-8-9;1-5(2,3)7-4-6/h2-3,8,10,14H,4-7H2,1H3,(H2,13,15);4H,1-3H3.
What are the key properties of 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate?
6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate has a molecular weight of 336.44 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methyl-N-piperidin-4-ylpyridine-3-carboxamide;tert-butyl formate is sourced from PubChem (CID 174638933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).