2-methyl-N-propan-2-yloxypropan-1-amine

C7H17NO — CID 123783708

IUPAC2-methyl-N-propan-2-yloxypropan-1-amine
SMILESCC(C)CNOC(C)C
InChIInChI=1S/C7H17NO/c1-6(2)5-8-9-7(3)4/h6-8H,5H2,1-4H3
InChIKeyCOANBULZWAAIEX-UHFFFAOYSA-N
MW131.22 g/mol
LogP1.57
Rot. Bonds4

About 2-methyl-N-propan-2-yloxypropan-1-amine

2-methyl-N-propan-2-yloxypropan-1-amine (PubChem CID 123783708) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is 2-methyl-N-propan-2-yloxypropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-propan-2-yloxypropan-1-amine
PubChem CID123783708
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name2-methyl-N-propan-2-yloxypropan-1-amine
SMILESCC(C)CNOC(C)C
InChIInChI=1S/C7H17NO/c1-6(2)5-8-9-7(3)4/h6-8H,5H2,1-4H3
InChIKeyCOANBULZWAAIEX-UHFFFAOYSA-N
XLogP1.57
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-methyl-N-propan-2-yloxypropan-1-amine 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

tris(2-methylpropylamino) borate
CID 18764137
2-(2-methylpropylamino)oxypentanal
CID 23150391
2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine
CID 167710729
CID 175939227
CID 175939227
N-bis(2-methylpropylamino)boranyl-2-methylpropan-1-amine
CID 18763880
N-cyclopentyloxy-2-methylpropan-1-amine
CID 83229850
1-(2-methylpropylamino)oxypropan-2-one
CID 23150488
2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
CID 519535
2-methyl-N-(2-propan-2-yloxypropyl)propan-1-amine
CID 62444418
1-but-3-en-2-yloxy-N-propan-2-yloxymethanamine
CID 163800021
2-(2-methylpropylamino)oxyacetamide
CID 112672654
2-methyl-N-(3-methylbutyl)propanamide;2-methyl-N-(2-methylpropylideneamino)propanamide;3-methyl-N-propan-2-ylbutan-1-amine;2-methyl-N-propan-2-yloxypropan-1-amine;N-(2-methylpropylideneamino)propan-2-amine
CID 158390100

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propan-2-yloxypropan-1-amine?
The IUPAC name of 2-methyl-N-propan-2-yloxypropan-1-amine (CID 123783708) is 2-methyl-N-propan-2-yloxypropan-1-amine.
What is the SMILES notation for 2-methyl-N-propan-2-yloxypropan-1-amine?
The canonical SMILES for 2-methyl-N-propan-2-yloxypropan-1-amine is CC(C)CNOC(C)C.
What is the InChIKey of 2-methyl-N-propan-2-yloxypropan-1-amine?
The InChIKey is COANBULZWAAIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO/c1-6(2)5-8-9-7(3)4/h6-8H,5H2,1-4H3.
What are the key properties of 2-methyl-N-propan-2-yloxypropan-1-amine?
2-methyl-N-propan-2-yloxypropan-1-amine has a molecular weight of 131.22 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propan-2-yloxypropan-1-amine is sourced from PubChem (CID 123783708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).