N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine

C14H26N2 — CID 123449552

IUPACN-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine
SMILESCCCC=CC=C(C)C(C)=NN(C)C(C)C
InChIInChI=1S/C14H26N2/c1-7-8-9-10-11-13(4)14(5)15-16(6)12(2)3/h9-12H,7-8H2,1-6H3
InChIKeyZVGGYMCVDKNANJ-UHFFFAOYSA-N
MW222.38 g/mol
LogP4.01
Rot. Bonds6

About N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine

N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine (PubChem CID 123449552) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine
PubChem CID123449552
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine
SMILESCCCC=CC=C(C)C(C)=NN(C)C(C)C
InChIInChI=1S/C14H26N2/c1-7-8-9-10-11-13(4)14(5)15-16(6)12(2)3/h9-12H,7-8H2,1-6H3
InChIKeyZVGGYMCVDKNANJ-UHFFFAOYSA-N
XLogP4.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 54.01
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

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N-methyl-N-[(E)-[(E)-3-methylpent-3-en-2-ylidene]amino]methanamine
CID 90141646
N-methyl-N-(3-methylidenehex-4-en-2-ylideneamino)ethanamine
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CID 123619306
6-ethenyl-3-ethyl-1-methyl-8aH-cinnoline
CID 123729667
N-(but-3-en-2-ylideneamino)-N-methylcyclohexa-2,4-dien-1-amine
CID 123792832
2-chloro-N-(4-methylhepta-1,4,6-trien-3-ylideneamino)-N-prop-1-en-2-ylprop-1-en-1-amine
CID 123884752
(2R)-1-N-ethyl-1-N,2-N-dimethyl-2-N-[(E)-[(Z)-3-methylidenehex-4-en-2-ylidene]amino]butane-1,2-diamine
CID 130449882
(2Z,5Z,7Z)-1-butyl-3-ethenyl-4-methylidenediazocine
CID 132197371
7-Ethyl-2,3-dimethyl-3,4-dihydrodiazepine
CID 134257675

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine?
The IUPAC name of N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine (CID 123449552) is N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine.
What is the SMILES notation for N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine?
The canonical SMILES for N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine is CCCC=CC=C(C)C(C)=NN(C)C(C)C.
What is the InChIKey of N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine?
The InChIKey is ZVGGYMCVDKNANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-7-8-9-10-11-13(4)14(5)15-16(6)12(2)3/h9-12H,7-8H2,1-6H3.
What are the key properties of N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine?
N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine has a molecular weight of 222.38 g/mol, XLogP of 4.01, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylnona-3,5-dien-2-ylideneamino)propan-2-amine is sourced from PubChem (CID 123449552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).