4-(aminomethyl)-5-methylnonan-5-ol

C11H25NO — CID 165443396

IUPAC4-(aminomethyl)-5-methylnonan-5-ol
SMILESCCCCC(C)(O)C(CN)CCC
InChIInChI=1S/C11H25NO/c1-4-6-8-11(3,13)10(9-12)7-5-2/h10,13H,4-9,12H2,1-3H3
InChIKeyWCAAVNMXKRPLQB-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.30
Rot. Bonds7

About 4-(aminomethyl)-5-methylnonan-5-ol

4-(aminomethyl)-5-methylnonan-5-ol (PubChem CID 165443396) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 4-(aminomethyl)-5-methylnonan-5-ol.

Molecular Properties

Compound Name4-(aminomethyl)-5-methylnonan-5-ol
PubChem CID165443396
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name4-(aminomethyl)-5-methylnonan-5-ol
SMILESCCCCC(C)(O)C(CN)CCC
InChIInChI=1S/C11H25NO/c1-4-6-8-11(3,13)10(9-12)7-5-2/h10,13H,4-9,12H2,1-3H3
InChIKeyWCAAVNMXKRPLQB-UHFFFAOYSA-N
XLogP2.30
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(aminomethyl)-3-ethylheptan-3-ol
CID 79416340
2-(2-fluoropropan-2-yl)pentan-1-amine
CID 105429102
(2S)-2-amino-3-methyloctadecane-1,3-diol
CID 11370484
3-chloro-2,4-dimethyloctane-2,4-diol
CID 102249443
4-amino-5-propyloctan-4-ol
CID 18625026
(3S)-2,3-dimethyloctan-3-ol
CID 25021578
4-tert-butyl-6,6-dimethyldecane
CID 173185098
5-propyldecane-4,4-diol
CID 156789084
4-amino-5-methylnonane-5-thiol
CID 146564263
methyl 3-hydroxy-2,3-dimethylheptanoate
CID 6422821
2,5,5-trimethylnonan-1-amine
CID 123431416
4,5-diaminodecan-5-ol
CID 155745471

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-5-methylnonan-5-ol?
The IUPAC name of 4-(aminomethyl)-5-methylnonan-5-ol (CID 165443396) is 4-(aminomethyl)-5-methylnonan-5-ol.
What is the SMILES notation for 4-(aminomethyl)-5-methylnonan-5-ol?
The canonical SMILES for 4-(aminomethyl)-5-methylnonan-5-ol is CCCCC(C)(O)C(CN)CCC.
What is the InChIKey of 4-(aminomethyl)-5-methylnonan-5-ol?
The InChIKey is WCAAVNMXKRPLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-4-6-8-11(3,13)10(9-12)7-5-2/h10,13H,4-9,12H2,1-3H3.
What are the key properties of 4-(aminomethyl)-5-methylnonan-5-ol?
4-(aminomethyl)-5-methylnonan-5-ol has a molecular weight of 187.33 g/mol, XLogP of 2.30, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-5-methylnonan-5-ol is sourced from PubChem (CID 165443396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).