N-methyl-N-propan-2-yloxan-4-amine

C9H19NO — CID 21034323

IUPACN-methyl-N-propan-2-yloxan-4-amine
SMILESCC(C)N(C)C1CCOCC1
InChIInChI=1S/C9H19NO/c1-8(2)10(3)9-4-6-11-7-5-9/h8-9H,4-7H2,1-3H3
InChIKeyJAJZTNSHDFRSMU-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.51
Rot. Bonds2

About N-methyl-N-propan-2-yloxan-4-amine

N-methyl-N-propan-2-yloxan-4-amine (PubChem CID 21034323) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-methyl-N-propan-2-yloxan-4-amine.

Molecular Properties

Compound NameN-methyl-N-propan-2-yloxan-4-amine
PubChem CID21034323
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-methyl-N-propan-2-yloxan-4-amine
SMILESCC(C)N(C)C1CCOCC1
InChIInChI=1S/C9H19NO/c1-8(2)10(3)9-4-6-11-7-5-9/h8-9H,4-7H2,1-3H3
InChIKeyJAJZTNSHDFRSMU-UHFFFAOYSA-N
XLogP1.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-propan-2-yloxan-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yloxan-4-amine?
The IUPAC name of N-methyl-N-propan-2-yloxan-4-amine (CID 21034323) is N-methyl-N-propan-2-yloxan-4-amine.
What is the SMILES notation for N-methyl-N-propan-2-yloxan-4-amine?
The canonical SMILES for N-methyl-N-propan-2-yloxan-4-amine is CC(C)N(C)C1CCOCC1.
What is the InChIKey of N-methyl-N-propan-2-yloxan-4-amine?
The InChIKey is JAJZTNSHDFRSMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)10(3)9-4-6-11-7-5-9/h8-9H,4-7H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-yloxan-4-amine?
N-methyl-N-propan-2-yloxan-4-amine has a molecular weight of 157.26 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yloxan-4-amine is sourced from PubChem (CID 21034323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).