(3R)-3,7-dimethyloctan-1-amine

C10H23N — CID 92974894

IUPAC(3R)-3,7-dimethyloctan-1-amine
SMILESCC(C)CCC[C@@H](C)CCN
InChIInChI=1S/C10H23N/c1-9(2)5-4-6-10(3)7-8-11/h9-10H,4-8,11H2,1-3H3/t10-/m1/s1
InChIKeyPPKSYRUVTABEIE-SNVBAGLBSA-N
MW157.30 g/mol
LogP2.80
Rot. Bonds6

About (3R)-3,7-dimethyloctan-1-amine

(3R)-3,7-dimethyloctan-1-amine (PubChem CID 92974894) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is (3R)-3,7-dimethyloctan-1-amine.

Molecular Properties

Compound Name(3R)-3,7-dimethyloctan-1-amine
PubChem CID92974894
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Name(3R)-3,7-dimethyloctan-1-amine
SMILESCC(C)CCC[C@@H](C)CCN
InChIInChI=1S/C10H23N/c1-9(2)5-4-6-10(3)7-8-11/h9-10H,4-8,11H2,1-3H3/t10-/m1/s1
InChIKeyPPKSYRUVTABEIE-SNVBAGLBSA-N
XLogP2.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3R)-3,11-dimethyldodecan-1-amine
CID 118054380
tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)
CID 173193055
(2S)-2,6-dimethylheptan-1-amine
CID 13329794
2,5,9,13-tetramethyltetradecane
CID 58292409
3-methyl-N'-(7-methyloctyl)hexane-1,6-diamine
CID 107815689
4,7-dimethyloctan-1-amine
CID 123439711
2,6,10,14,18,22,26-heptamethyloctacosane
CID 6428605
3-methylpentadecan-1-amine
CID 57147657
3,8,9-trimethyldecan-1-amine
CID 155084510
(2S,6S)-6,10-dimethylundecan-2-ol
CID 92938997
2,6,10,15,19-pentamethylhenicosane
CID 6428617
2,6,10,14,19-pentamethyltetracosane
CID 6428632

Frequently Asked Questions

What is the IUPAC name of (3R)-3,7-dimethyloctan-1-amine?
The IUPAC name of (3R)-3,7-dimethyloctan-1-amine (CID 92974894) is (3R)-3,7-dimethyloctan-1-amine.
What is the SMILES notation for (3R)-3,7-dimethyloctan-1-amine?
The canonical SMILES for (3R)-3,7-dimethyloctan-1-amine is CC(C)CCC[C@@H](C)CCN.
What is the InChIKey of (3R)-3,7-dimethyloctan-1-amine?
The InChIKey is PPKSYRUVTABEIE-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H23N/c1-9(2)5-4-6-10(3)7-8-11/h9-10H,4-8,11H2,1-3H3/t10-/m1/s1.
What are the key properties of (3R)-3,7-dimethyloctan-1-amine?
(3R)-3,7-dimethyloctan-1-amine has a molecular weight of 157.30 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3,7-dimethyloctan-1-amine is sourced from PubChem (CID 92974894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).