N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine

C9H19N3 — CID 11480685

IUPACN,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine
SMILESCCCN=C=NCCCN(C)C
InChIInChI=1S/C9H19N3/c1-4-6-10-9-11-7-5-8-12(2)3/h4-8H2,1-3H3
InChIKeyQRIAHZBQBDMKGT-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.52
Rot. Bonds6

About N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine

N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine (PubChem CID 11480685) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine
PubChem CID11480685
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC NameN,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine
SMILESCCCN=C=NCCCN(C)C
InChIInChI=1S/C9H19N3/c1-4-6-10-9-11-7-5-8-12(2)3/h4-8H2,1-3H3
InChIKeyQRIAHZBQBDMKGT-UHFFFAOYSA-N
XLogP1.52
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

azane;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 146446789
azane;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;hydrochloride
CID 174499626
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;silver;hydrochloride
CID 174929426
2-(butyliminomethylideneamino)-N,N-dimethylethanamine
CID 134871643
ethene;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;hydrochloride
CID 87575427
butan-1-ol;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 170171084
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;propan-2-one
CID 158337348
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;methylsulfinylmethane
CID 87433592
N,N'-dipropylmethanediimine
CID 12725951
3-(2,2-dimethylpropyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 174829721
1-chlorotetradecane;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;hydrochloride
CID 174522599
N'-pentyl-N-propylmethanediimine
CID 88904849

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine?
The IUPAC name of N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine (CID 11480685) is N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine?
The canonical SMILES for N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine is CCCN=C=NCCCN(C)C.
What is the InChIKey of N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine?
The InChIKey is QRIAHZBQBDMKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c1-4-6-10-9-11-7-5-8-12(2)3/h4-8H2,1-3H3.
What are the key properties of N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine?
N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine has a molecular weight of 169.27 g/mol, XLogP of 1.52, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine is sourced from PubChem (CID 11480685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).