N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide

C14H21N5O — CID 103385773

IUPACN-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide
SMILESCC(Nc1nccc2c1ncn2C)C(=O)NC(C)(C)C
InChIInChI=1S/C14H21N5O/c1-9(13(20)18-14(2,3)4)17-12-11-10(6-7-15-12)19(5)8-16-11/h6-9H,1-5H3,(H,15,17)(H,18,20)
InChIKeyFYEAISYHSBANLM-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.68
Rot. Bonds3

About N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide

N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide (PubChem CID 103385773) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide
PubChem CID103385773
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide
SMILESCC(Nc1nccc2c1ncn2C)C(=O)NC(C)(C)C
InChIInChI=1S/C14H21N5O/c1-9(13(20)18-14(2,3)4)17-12-11-10(6-7-15-12)19(5)8-16-11/h6-9H,1-5H3,(H,15,17)(H,18,20)
InChIKeyFYEAISYHSBANLM-UHFFFAOYSA-N
XLogP1.68
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide?
The IUPAC name of N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide (CID 103385773) is N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide.
What is the SMILES notation for N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide?
The canonical SMILES for N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide is CC(Nc1nccc2c1ncn2C)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide?
The InChIKey is FYEAISYHSBANLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-9(13(20)18-14(2,3)4)17-12-11-10(6-7-15-12)19(5)8-16-11/h6-9H,1-5H3,(H,15,17)(H,18,20).
What are the key properties of N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide?
N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide has a molecular weight of 275.36 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanamide is sourced from PubChem (CID 103385773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).