N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine

C10H18N2 — CID 11457890

IUPACN,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine
SMILESC=C(C#CCN(C)C)CN(C)C
InChIInChI=1S/C10H18N2/c1-10(9-12(4)5)7-6-8-11(2)3/h1,8-9H2,2-5H3
InChIKeyDEYDABRAOMJUJQ-UHFFFAOYSA-N
MW166.27 g/mol
LogP0.67
Rot. Bonds3

About N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine

N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine (PubChem CID 11457890) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine.

Molecular Properties

Compound NameN,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine
PubChem CID11457890
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine
SMILESC=C(C#CCN(C)C)CN(C)C
InChIInChI=1S/C10H18N2/c1-10(9-12(4)5)7-6-8-11(2)3/h1,8-9H2,2-5H3
InChIKeyDEYDABRAOMJUJQ-UHFFFAOYSA-N
XLogP0.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethyl-4-methylpent-4-en-2-yn-1-amine
CID 1990327
N,N,4-Trimethyl-4-penten-2-yn-1-amine
CID 535764
trimethyl-[(Z)-3-methylpent-2-en-4-ynyl]azanium
CID 21678748
N,N,2-trimethyl-N-(prop-2-yn-1-yl)prop-2-en-1-aminium
CID 1388069
N,N,N',N'-tetramethyl-2-methylidenepropane-1,3-diamine
CID 23422704
N,N,5-trimethylhept-5-en-3-yn-1-amine
CID 123168389
2-methylidene-N,N-bis(2-methylprop-2-enyl)but-3-yn-1-amine
CID 146507772
ethane;N,N,2-trimethylprop-2-en-1-amine
CID 153380728
4-methyl-N,N-dipropylpent-4-en-2-yn-1-amine
CID 12576992
N,N,N,4-Tetramethylpent-4-en-2-yn-1-aminium iodide
CID 13214283
Trimethyl(4-methylpent-4-en-2-ynyl)azanium
CID 13214284
N,N,2-trimethyl-N-(prop-2-yn-1-yl)prop-2-en-1-aminium iodide
CID 44658499

Frequently Asked Questions

What is the IUPAC name of N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine?
The IUPAC name of N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine (CID 11457890) is N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine.
What is the SMILES notation for N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine?
The canonical SMILES for N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine is C=C(C#CCN(C)C)CN(C)C.
What is the InChIKey of N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine?
The InChIKey is DEYDABRAOMJUJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-10(9-12(4)5)7-6-8-11(2)3/h1,8-9H2,2-5H3.
What are the key properties of N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine?
N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine has a molecular weight of 166.27 g/mol, XLogP of 0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N'-tetramethyl-4-methylidenepent-2-yne-1,5-diamine is sourced from PubChem (CID 11457890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).