N-methyl-N-[(Z)-propylideneamino]propan-2-amine

C7H16N2 — CID 167054285

IUPACN-methyl-N-[(Z)-propylideneamino]propan-2-amine
SMILESCC/C=N\N(C)C(C)C
InChIInChI=1S/C7H16N2/c1-5-6-8-9(4)7(2)3/h6-7H,5H2,1-4H3/b8-6-
InChIKeyGVUDKVNBBOZKKY-VURMDHGXSA-N
MW128.22 g/mol
LogP1.72
Rot. Bonds3

About N-methyl-N-[(Z)-propylideneamino]propan-2-amine

N-methyl-N-[(Z)-propylideneamino]propan-2-amine (PubChem CID 167054285) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is N-methyl-N-[(Z)-propylideneamino]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(Z)-propylideneamino]propan-2-amine
PubChem CID167054285
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC NameN-methyl-N-[(Z)-propylideneamino]propan-2-amine
SMILESCC/C=N\N(C)C(C)C
InChIInChI=1S/C7H16N2/c1-5-6-8-9(4)7(2)3/h6-7H,5H2,1-4H3/b8-6-
InChIKeyGVUDKVNBBOZKKY-VURMDHGXSA-N
XLogP1.72
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Related Compounds

N-amino-N-[(Z)-propylideneamino]methanamine
CID 146181001
N-(ethylideneamino)-N-(propylideneamino)methanamine
CID 123951853
N-methyl-N-(propylideneamino)formamide
CID 71373891
N-[(Z)-[methyl(propan-2-yl)hydrazinylidene]methyl]formamide
CID 139361032
CID 59045042
CID 59045042
N-ethyl-N'-methyl-N'-[(Z)-propylideneamino]methanediamine
CID 154968831
N-butan-2-ylpropan-1-imine;ethane
CID 143076356
2-(propylideneamino)propan-1-amine
CID 147518920
N'-ethenyl-N'-[(Z)-propylideneamino]ethane-1,2-diamine
CID 143110172
N-methyl-N-propoxyphosphanylpropan-2-amine
CID 155719584
N-methyl-N-(propylideneamino)hexa-1,3,5-trien-2-amine
CID 123468656
1-methyl-3-methylidene-1-[(Z)-propylideneamino]guanidine
CID 90839193

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(Z)-propylideneamino]propan-2-amine?
The IUPAC name of N-methyl-N-[(Z)-propylideneamino]propan-2-amine (CID 167054285) is N-methyl-N-[(Z)-propylideneamino]propan-2-amine.
What is the SMILES notation for N-methyl-N-[(Z)-propylideneamino]propan-2-amine?
The canonical SMILES for N-methyl-N-[(Z)-propylideneamino]propan-2-amine is CC/C=N\N(C)C(C)C.
What is the InChIKey of N-methyl-N-[(Z)-propylideneamino]propan-2-amine?
The InChIKey is GVUDKVNBBOZKKY-VURMDHGXSA-N. The full InChI is InChI=1S/C7H16N2/c1-5-6-8-9(4)7(2)3/h6-7H,5H2,1-4H3/b8-6-.
What are the key properties of N-methyl-N-[(Z)-propylideneamino]propan-2-amine?
N-methyl-N-[(Z)-propylideneamino]propan-2-amine has a molecular weight of 128.22 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(Z)-propylideneamino]propan-2-amine is sourced from PubChem (CID 167054285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).