N,6-dimethylnon-8-yn-2-amine

C11H21N — CID 91517434

IUPACN,6-dimethylnon-8-yn-2-amine
SMILESC#CCC(C)CCCC(C)NC
InChIInChI=1S/C11H21N/c1-5-7-10(2)8-6-9-11(3)12-4/h1,10-12H,6-9H2,2-4H3
InChIKeyBYYWBTHALWBSPS-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.42
Rot. Bonds6

About N,6-dimethylnon-8-yn-2-amine

N,6-dimethylnon-8-yn-2-amine (PubChem CID 91517434) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N,6-dimethylnon-8-yn-2-amine.

Molecular Properties

Compound NameN,6-dimethylnon-8-yn-2-amine
PubChem CID91517434
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN,6-dimethylnon-8-yn-2-amine
SMILESC#CCC(C)CCCC(C)NC
InChIInChI=1S/C11H21N/c1-5-7-10(2)8-6-9-11(3)12-4/h1,10-12H,6-9H2,2-4H3
InChIKeyBYYWBTHALWBSPS-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-methylnon-8-yn-2-amine
CID 91435283
4-methylnon-1-yne
CID 20743131
4-methylhept-6-ynal
CID 130035295
(2R)-5-chloro-N-methylpentan-2-amine
CID 129120324
N-tert-butyl-3-methylhex-5-yn-1-amine
CID 81018738
6,10,14-trimethylpentadec-1-yne
CID 72780458
N-ethylpent-4-yn-2-amine
CID 62233889
N-methyltetradecan-2-amine
CID 54073704
N-[4-(methylamino)pentyl]formamide
CID 153396942
N-butylpent-4-yn-2-amine;ethane
CID 144551076
N-pent-4-yn-2-ylpentan-3-amine
CID 115725330
3,7,11,15-tetramethylhexadec-1-yne
CID 90737632

Frequently Asked Questions

What is the IUPAC name of N,6-dimethylnon-8-yn-2-amine?
The IUPAC name of N,6-dimethylnon-8-yn-2-amine (CID 91517434) is N,6-dimethylnon-8-yn-2-amine.
What is the SMILES notation for N,6-dimethylnon-8-yn-2-amine?
The canonical SMILES for N,6-dimethylnon-8-yn-2-amine is C#CCC(C)CCCC(C)NC.
What is the InChIKey of N,6-dimethylnon-8-yn-2-amine?
The InChIKey is BYYWBTHALWBSPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-5-7-10(2)8-6-9-11(3)12-4/h1,10-12H,6-9H2,2-4H3.
What are the key properties of N,6-dimethylnon-8-yn-2-amine?
N,6-dimethylnon-8-yn-2-amine has a molecular weight of 167.30 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethylnon-8-yn-2-amine is sourced from PubChem (CID 91517434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).