4,4-dimethylnonan-5-amine

C11H25N — CID 87513740

IUPAC4,4-dimethylnonan-5-amine
SMILESCCCCC(N)C(C)(C)CCC
InChIInChI=1S/C11H25N/c1-5-7-8-10(12)11(3,4)9-6-2/h10H,5-9,12H2,1-4H3
InChIKeyHMLXGHJKZPGCND-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.33
Rot. Bonds6

About 4,4-dimethylnonan-5-amine

4,4-dimethylnonan-5-amine (PubChem CID 87513740) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 4,4-dimethylnonan-5-amine.

Molecular Properties

Compound Name4,4-dimethylnonan-5-amine
PubChem CID87513740
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name4,4-dimethylnonan-5-amine
SMILESCCCCC(N)C(C)(C)CCC
InChIInChI=1S/C11H25N/c1-5-7-8-10(12)11(3,4)9-6-2/h10H,5-9,12H2,1-4H3
InChIKeyHMLXGHJKZPGCND-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-dimethylicosan-5-amine;hydrobromide
CID 173152006
2,2-difluoroheptan-3-amine
CID 130605107
1-cyclopropyl-2,2-dimethylheptan-3-amine
CID 134293473
1,1,1-trifluorohexan-2-amine
CID 50998628
(3S)-2,2-dimethyloctan-3-amine
CID 93237613
3,3,6,6-tetramethylnonan-5-amine
CID 89328233
(3R)-2,2-dimethylpentadecan-3-amine
CID 124525155
1,2-diaminohexane-1,1-diol
CID 19776231
2,2-dimethyldodecan-3-amine
CID 43370499
(2R)-1,1,1-trifluorohexan-2-amine;hydrochloride
CID 171203125
2-methyldecane-2,3-diamine
CID 87934186
11,11,12-tributyloctacosan-10-amine
CID 87948518

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethylnonan-5-amine?
The IUPAC name of 4,4-dimethylnonan-5-amine (CID 87513740) is 4,4-dimethylnonan-5-amine.
What is the SMILES notation for 4,4-dimethylnonan-5-amine?
The canonical SMILES for 4,4-dimethylnonan-5-amine is CCCCC(N)C(C)(C)CCC.
What is the InChIKey of 4,4-dimethylnonan-5-amine?
The InChIKey is HMLXGHJKZPGCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-5-7-8-10(12)11(3,4)9-6-2/h10H,5-9,12H2,1-4H3.
What are the key properties of 4,4-dimethylnonan-5-amine?
4,4-dimethylnonan-5-amine has a molecular weight of 171.33 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethylnonan-5-amine is sourced from PubChem (CID 87513740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).