N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide

C14H23N3O2 — CID 105071169

IUPACN-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCC(C)(C)OC
InChIInChI=1S/C14H23N3O2/c1-5-7-16-12-9-15-8-6-11(12)13(18)17-10-14(2,3)19-4/h6,8-9,16H,5,7,10H2,1-4H3,(H,17,18)
InChIKeyAUAQTCQRDMYXHJ-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.06
Rot. Bonds7

About N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide

N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105071169) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID105071169
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCC(C)(C)OC
InChIInChI=1S/C14H23N3O2/c1-5-7-16-12-9-15-8-6-11(12)13(18)17-10-14(2,3)19-4/h6,8-9,16H,5,7,10H2,1-4H3,(H,17,18)
InChIKeyAUAQTCQRDMYXHJ-UHFFFAOYSA-N
XLogP2.06
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 106295553
N-[2-(2-methoxyethylamino)-2-oxoethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071089
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587
N-(3-butoxypropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071243
N-[(3-methyl-4-pyridinyl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071463
N-(3-cyclopropylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071385
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
N-(3-methylsulfanylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105070236
N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068347
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
3-(propylamino)-N-(2-pyrazol-1-ylethyl)pyridine-4-carboxamide
CID 105069612
N-[2-(dimethylsulfamoyl)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 106342677

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide (CID 105071169) is N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NCC(C)(C)OC.
What is the InChIKey of N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is AUAQTCQRDMYXHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-5-7-16-12-9-15-8-6-11(12)13(18)17-10-14(2,3)19-4/h6,8-9,16H,5,7,10H2,1-4H3,(H,17,18).
What are the key properties of N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide?
N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 2.06, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105071169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).