4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide

C13H21N3O3 — CID 103155628

IUPAC4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
SMILESCOC(CN)CC(=O)Nc1cccnc1OC(C)C
InChIInChI=1S/C13H21N3O3/c1-9(2)19-13-11(5-4-6-15-13)16-12(17)7-10(8-14)18-3/h4-6,9-10H,7-8,14H2,1-3H3,(H,16,17)
InChIKeyYPPLXWWEHREJBN-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.17
Rot. Bonds7

About 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide

4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide (PubChem CID 103155628) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide.

Molecular Properties

Compound Name4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
PubChem CID103155628
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
SMILESCOC(CN)CC(=O)Nc1cccnc1OC(C)C
InChIInChI=1S/C13H21N3O3/c1-9(2)19-13-11(5-4-6-15-13)16-12(17)7-10(8-14)18-3/h4-6,9-10H,7-8,14H2,1-3H3,(H,16,17)
InChIKeyYPPLXWWEHREJBN-UHFFFAOYSA-N
XLogP1.17
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-aminoethoxy)-N-(2-propan-2-yloxy-3-pyridinyl)acetamide
CID 79479427
4-oxo-4-[(2-propan-2-yloxy-3-pyridinyl)amino]butanoic acid
CID 61379431
2-(aminomethyl)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 65229294
4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 61379540
3-(ethylamino)-N-(2-propan-2-yloxy-3-pyridinyl)propanamide
CID 62834244
2-(1-aminocyclohexyl)-N-(2-propan-2-yloxy-3-pyridinyl)acetamide
CID 64677402
(2S)-2-amino-3-methyl-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 61379065
2-amino-3-methyl-N-(2-propan-2-yloxy-3-pyridinyl)pentanamide
CID 61379490
2-chloro-N-(2-propan-2-yloxy-3-pyridinyl)propanamide
CID 61379626
2-[(4-amino-3-methoxybutanoyl)amino]-N,N-dimethylbenzamide
CID 103154460
2-bromo-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 62855618
4-amino-3-methoxy-N-(5-methoxy-2-propan-2-yloxyphenyl)butanamide
CID 120591665

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The IUPAC name of 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide (CID 103155628) is 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide.
What is the SMILES notation for 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The canonical SMILES for 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide is COC(CN)CC(=O)Nc1cccnc1OC(C)C.
What is the InChIKey of 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The InChIKey is YPPLXWWEHREJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-9(2)19-13-11(5-4-6-15-13)16-12(17)7-10(8-14)18-3/h4-6,9-10H,7-8,14H2,1-3H3,(H,16,17).
What are the key properties of 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide has a molecular weight of 267.33 g/mol, XLogP of 1.17, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide is sourced from PubChem (CID 103155628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).