(4S,5S)-4-amino-2-methylnonan-5-ol

C10H23NO — CID 10487437

IUPAC(4S,5S)-4-amino-2-methylnonan-5-ol
SMILESCCCC[C@H](O)[C@@H](N)CC(C)C
InChIInChI=1S/C10H23NO/c1-4-5-6-10(12)9(11)7-8(2)3/h8-10,12H,4-7,11H2,1-3H3/t9-,10-/m0/s1
InChIKeyABAFATZXWZOIKK-UWVGGRQHSA-N
MW173.30 g/mol
LogP1.91
Rot. Bonds6

About (4S,5S)-4-amino-2-methylnonan-5-ol

(4S,5S)-4-amino-2-methylnonan-5-ol (PubChem CID 10487437) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is (4S,5S)-4-amino-2-methylnonan-5-ol.

Molecular Properties

Compound Name(4S,5S)-4-amino-2-methylnonan-5-ol
PubChem CID10487437
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name(4S,5S)-4-amino-2-methylnonan-5-ol
SMILESCCCC[C@H](O)[C@@H](N)CC(C)C
InChIInChI=1S/C10H23NO/c1-4-5-6-10(12)9(11)7-8(2)3/h8-10,12H,4-7,11H2,1-3H3/t9-,10-/m0/s1
InChIKeyABAFATZXWZOIKK-UWVGGRQHSA-N
XLogP1.91
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Xestoaminol C
CID 14756407
Paecilaminol
CID 10236627
(2S,3R)-2-Aminododecan-3-Ol
CID 5273358
3-Hexanol, 4-amino-2-methyl-
CID 44674
4-Octanol, 3-amino-
CID 55284966
15-Methylhexadecasphinganine
CID 70679000
Clavaminol A
CID 16739261
3-Epi-Xestoaminol C
CID 90683233
(3S,4R)-3-amino-2-methylnonadecan-4-ol
CID 9857993
(3S,4S,5R)-4-amino-3-methylicosan-5-ol
CID 9967180
(2R,3S)-2-amino-11-methyldodecan-3-ol
CID 44127631
2-Amino-1-cycloundecyl-ethanol
CID 44272314

Frequently Asked Questions

What is the IUPAC name of (4S,5S)-4-amino-2-methylnonan-5-ol?
The IUPAC name of (4S,5S)-4-amino-2-methylnonan-5-ol (CID 10487437) is (4S,5S)-4-amino-2-methylnonan-5-ol.
What is the SMILES notation for (4S,5S)-4-amino-2-methylnonan-5-ol?
The canonical SMILES for (4S,5S)-4-amino-2-methylnonan-5-ol is CCCC[C@H](O)[C@@H](N)CC(C)C.
What is the InChIKey of (4S,5S)-4-amino-2-methylnonan-5-ol?
The InChIKey is ABAFATZXWZOIKK-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H23NO/c1-4-5-6-10(12)9(11)7-8(2)3/h8-10,12H,4-7,11H2,1-3H3/t9-,10-/m0/s1.
What are the key properties of (4S,5S)-4-amino-2-methylnonan-5-ol?
(4S,5S)-4-amino-2-methylnonan-5-ol has a molecular weight of 173.30 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-4-amino-2-methylnonan-5-ol is sourced from PubChem (CID 10487437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).