N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide

C12H19N3O2 — CID 110834154

IUPACN-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide
SMILESCC(C)(CN)NC(=O)CCOc1cccnc1
InChIInChI=1S/C12H19N3O2/c1-12(2,9-13)15-11(16)5-7-17-10-4-3-6-14-8-10/h3-4,6,8H,5,7,9,13H2,1-2H3,(H,15,16)
InChIKeyOIQAQVPNWIZVEW-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.70
Rot. Bonds6

About N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide

N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide (PubChem CID 110834154) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide
PubChem CID110834154
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide
SMILESCC(C)(CN)NC(=O)CCOc1cccnc1
InChIInChI=1S/C12H19N3O2/c1-12(2,9-13)15-11(16)5-7-17-10-4-3-6-14-8-10/h3-4,6,8H,5,7,9,13H2,1-2H3,(H,15,16)
InChIKeyOIQAQVPNWIZVEW-UHFFFAOYSA-N
XLogP0.70
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-3-(3-bromophenoxy)propanamide
CID 119522531
N-(1-amino-2-methylpropan-2-yl)-3-(4-fluorophenoxy)propanamide;hydrochloride
CID 119522331
N-(1-amino-2-methylpropan-2-yl)-3-(3,5-dimethylphenoxy)propanamide
CID 110834140
2-pyridin-3-yloxy-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 110487966
(2S)-2-(3-pyridin-3-yloxypropanoylamino)propanoic acid
CID 110837106
3-(3-pyridin-3-yloxypropanoylamino)propanoic acid
CID 110837112
4-(3-acetylphenoxy)-N-(1-amino-2-methylpropan-2-yl)butanamide
CID 119524189
N-(1-amino-2-methylpropan-2-yl)-4-(4-iodophenoxy)butanamide
CID 119524592
N-(1-amino-2-methylpropan-2-yl)-3-(2-bromophenoxy)propanamide
CID 119521510
N,N-dimethyl-4-pyridin-3-yloxybutanamide
CID 110486958
3-(3-bromophenoxy)-N-(1-hydroxy-2-methylpropan-2-yl)propanamide
CID 43390558
3-[methyl(3-pyridin-3-yloxypropanoyl)amino]propanoic acid
CID 110837113

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide (CID 110834154) is N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide is CC(C)(CN)NC(=O)CCOc1cccnc1.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide?
The InChIKey is OIQAQVPNWIZVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-12(2,9-13)15-11(16)5-7-17-10-4-3-6-14-8-10/h3-4,6,8H,5,7,9,13H2,1-2H3,(H,15,16).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide?
N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide has a molecular weight of 237.30 g/mol, XLogP of 0.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-3-pyridin-3-yloxypropanamide is sourced from PubChem (CID 110834154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).