4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide

C15H25N3O2 — CID 61379540

IUPAC4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
SMILESCC(C)NCCCC(=O)Nc1cccnc1OC(C)C
InChIInChI=1S/C15H25N3O2/c1-11(2)16-9-6-8-14(19)18-13-7-5-10-17-15(13)20-12(3)4/h5,7,10-12,16H,6,8-9H2,1-4H3,(H,18,19)
InChIKeyAHRYHEFBUJDFSW-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.59
Rot. Bonds8

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

4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide (PubChem CID 61379540) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide.

Molecular Properties

Compound Name4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
PubChem CID61379540
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
SMILESCC(C)NCCCC(=O)Nc1cccnc1OC(C)C
InChIInChI=1S/C15H25N3O2/c1-11(2)16-9-6-8-14(19)18-13-7-5-10-17-15(13)20-12(3)4/h5,7,10-12,16H,6,8-9H2,1-4H3,(H,18,19)
InChIKeyAHRYHEFBUJDFSW-UHFFFAOYSA-N
XLogP2.59
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-oxo-4-[(2-propan-2-yloxy-3-pyridinyl)amino]butanoic acid
CID 61379431
3-(ethylamino)-N-(2-propan-2-yloxy-3-pyridinyl)propanamide
CID 62834244
4-amino-3-methoxy-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 103155628
2-(2-aminoethoxy)-N-(2-propan-2-yloxy-3-pyridinyl)acetamide
CID 79479427
2-(1-aminocyclohexyl)-N-(2-propan-2-yloxy-3-pyridinyl)acetamide
CID 64677402
N-(2-chloro-3-pyridinyl)-3-(propan-2-ylamino)propanamide
CID 60853808
1-(3-methylbutyl)-3-(2-propan-2-yloxy-3-pyridinyl)urea
CID 112831617
2-chloro-N-(2-propan-2-yloxy-3-pyridinyl)propanamide
CID 61379626
4-(propan-2-ylamino)-N-(2-propoxyphenyl)butanamide
CID 60851317
N-[2-(hydroxymethyl)phenyl]-4-(propan-2-ylamino)butanamide
CID 60850282
2-bromo-N-(2-propan-2-yloxy-3-pyridinyl)butanamide
CID 62855618
N-[2-(methoxymethyl)phenyl]-4-(propan-2-ylamino)butanamide
CID 54927933

Frequently Asked Questions

What is the IUPAC name of 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The IUPAC name of 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide (CID 61379540) is 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide.
What is the SMILES notation for 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The canonical SMILES for 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide is CC(C)NCCCC(=O)Nc1cccnc1OC(C)C.
What is the InChIKey of 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
The InChIKey is AHRYHEFBUJDFSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11(2)16-9-6-8-14(19)18-13-7-5-10-17-15(13)20-12(3)4/h5,7,10-12,16H,6,8-9H2,1-4H3,(H,18,19).
What are the key properties of 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide?
4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide has a molecular weight of 279.38 g/mol, XLogP of 2.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propan-2-ylamino)-N-(2-propan-2-yloxy-3-pyridinyl)butanamide is sourced from PubChem (CID 61379540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).