N-(ethylideneamino)-N-(propylideneamino)methanamine

C6H13N3 — CID 123951853

IUPACN-(ethylideneamino)-N-(propylideneamino)methanamine
SMILESCC=NN(C)N=CCC
InChIInChI=1S/C6H13N3/c1-4-6-8-9(3)7-5-2/h5-6H,4H2,1-3H3
InChIKeyDGSHUYIXVNLUHS-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.32
Rot. Bonds3

About N-(ethylideneamino)-N-(propylideneamino)methanamine

N-(ethylideneamino)-N-(propylideneamino)methanamine (PubChem CID 123951853) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is N-(ethylideneamino)-N-(propylideneamino)methanamine.

Molecular Properties

Compound NameN-(ethylideneamino)-N-(propylideneamino)methanamine
PubChem CID123951853
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC NameN-(ethylideneamino)-N-(propylideneamino)methanamine
SMILESCC=NN(C)N=CCC
InChIInChI=1S/C6H13N3/c1-4-6-8-9(3)7-5-2/h5-6H,4H2,1-3H3
InChIKeyDGSHUYIXVNLUHS-UHFFFAOYSA-N
XLogP1.32
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(ethylideneamino)-N-(propylideneamino)methanamine?
The IUPAC name of N-(ethylideneamino)-N-(propylideneamino)methanamine (CID 123951853) is N-(ethylideneamino)-N-(propylideneamino)methanamine.
What is the SMILES notation for N-(ethylideneamino)-N-(propylideneamino)methanamine?
The canonical SMILES for N-(ethylideneamino)-N-(propylideneamino)methanamine is CC=NN(C)N=CCC.
What is the InChIKey of N-(ethylideneamino)-N-(propylideneamino)methanamine?
The InChIKey is DGSHUYIXVNLUHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3/c1-4-6-8-9(3)7-5-2/h5-6H,4H2,1-3H3.
What are the key properties of N-(ethylideneamino)-N-(propylideneamino)methanamine?
N-(ethylideneamino)-N-(propylideneamino)methanamine has a molecular weight of 127.19 g/mol, XLogP of 1.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylideneamino)-N-(propylideneamino)methanamine is sourced from PubChem (CID 123951853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).