4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide

C14H29N3O2 — CID 66430004

IUPAC4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide
SMILESCN(C1CCOCC1)C(CN)CC(=O)NC(C)(C)C
InChIInChI=1S/C14H29N3O2/c1-14(2,3)16-13(18)9-12(10-15)17(4)11-5-7-19-8-6-11/h11-12H,5-10,15H2,1-4H3,(H,16,18)
InChIKeyVJUUFNDUASEFQN-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.73
Rot. Bonds5

About 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide

4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide (PubChem CID 66430004) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide
PubChem CID66430004
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide
SMILESCN(C1CCOCC1)C(CN)CC(=O)NC(C)(C)C
InChIInChI=1S/C14H29N3O2/c1-14(2,3)16-13(18)9-12(10-15)17(4)11-5-7-19-8-6-11/h11-12H,5-10,15H2,1-4H3,(H,16,18)
InChIKeyVJUUFNDUASEFQN-UHFFFAOYSA-N
XLogP0.73
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]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-amino-N-tert-butyl-3-[cycloheptyl(methyl)amino]butanamide
CID 66430006
4-amino-N-cyclopropyl-3-[methyl(oxolan-3-yl)amino]butanamide
CID 82735649
4-amino-N-tert-butyl-3-[methyl(oxan-2-ylmethyl)amino]butanamide
CID 66432458
4-amino-N-tert-butyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
CID 66432868
4-amino-N-tert-butyl-3-[methyl(propyl)amino]butanamide
CID 66431224
4-amino-N-tert-butyl-3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]butanamide
CID 105414000
4-amino-N-tert-butyl-3-[1-(dimethylamino)propan-2-yl-ethylamino]butanamide
CID 103188107
4-amino-N-tert-butyl-3-[3-(dimethylamino)pyrrolidin-1-yl]butanamide
CID 66431436
4-amino-3-[cycloheptyl(methyl)amino]-1-piperidin-1-ylbutan-1-one
CID 66430294
2-amino-2-methyl-4-[methyl(oxan-4-yl)amino]pentanoic acid
CID 64709217
4-amino-N-tert-butyl-3-[furan-3-ylmethyl(methyl)amino]butanamide
CID 66431838
ethyl 2-(ethylamino)-2-methyl-4-[methyl(oxan-4-yl)amino]pentanoate
CID 64710194

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide?
The IUPAC name of 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide (CID 66430004) is 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide.
What is the SMILES notation for 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide?
The canonical SMILES for 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide is CN(C1CCOCC1)C(CN)CC(=O)NC(C)(C)C.
What is the InChIKey of 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide?
The InChIKey is VJUUFNDUASEFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-14(2,3)16-13(18)9-12(10-15)17(4)11-5-7-19-8-6-11/h11-12H,5-10,15H2,1-4H3,(H,16,18).
What are the key properties of 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide?
4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide has a molecular weight of 271.40 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-tert-butyl-3-[methyl(oxan-4-yl)amino]butanamide is sourced from PubChem (CID 66430004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).