1-methylimino-N-propan-2-ylpropan-2-amine

C7H16N2 — CID 141270836

IUPAC1-methylimino-N-propan-2-ylpropan-2-amine
SMILESC/N=C/C(C)NC(C)C
InChIInChI=1S/C7H16N2/c1-6(2)9-7(3)5-8-4/h5-7,9H,1-4H3/b8-5+
InChIKeyDPBFZJKHUSGWQR-VMPITWQZSA-N
MW128.22 g/mol
LogP1.07
Rot. Bonds3

About 1-methylimino-N-propan-2-ylpropan-2-amine

1-methylimino-N-propan-2-ylpropan-2-amine (PubChem CID 141270836) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-methylimino-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-methylimino-N-propan-2-ylpropan-2-amine
PubChem CID141270836
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1-methylimino-N-propan-2-ylpropan-2-amine
SMILESC/N=C/C(C)NC(C)C
InChIInChI=1S/C7H16N2/c1-6(2)9-7(3)5-8-4/h5-7,9H,1-4H3/b8-5+
InChIKeyDPBFZJKHUSGWQR-VMPITWQZSA-N
XLogP1.07
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methylimino-N-propan-2-ylpropan-2-amine?
The IUPAC name of 1-methylimino-N-propan-2-ylpropan-2-amine (CID 141270836) is 1-methylimino-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for 1-methylimino-N-propan-2-ylpropan-2-amine?
The canonical SMILES for 1-methylimino-N-propan-2-ylpropan-2-amine is C/N=C/C(C)NC(C)C.
What is the InChIKey of 1-methylimino-N-propan-2-ylpropan-2-amine?
The InChIKey is DPBFZJKHUSGWQR-VMPITWQZSA-N. The full InChI is InChI=1S/C7H16N2/c1-6(2)9-7(3)5-8-4/h5-7,9H,1-4H3/b8-5+.
What are the key properties of 1-methylimino-N-propan-2-ylpropan-2-amine?
1-methylimino-N-propan-2-ylpropan-2-amine has a molecular weight of 128.22 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylimino-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 141270836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).