(3S,6R)-6-methyldecan-3-amine

C11H25N — CID 88893264

IUPAC(3S,6R)-6-methyldecan-3-amine
SMILESCCCC[C@@H](C)CC[C@@H](N)CC
InChIInChI=1S/C11H25N/c1-4-6-7-10(3)8-9-11(12)5-2/h10-11H,4-9,12H2,1-3H3/t10-,11+/m1/s1
InChIKeyKLJLECHUMGMPSB-MNOVXSKESA-N
MW171.33 g/mol
LogP3.33
Rot. Bonds7

About (3S,6R)-6-methyldecan-3-amine

(3S,6R)-6-methyldecan-3-amine (PubChem CID 88893264) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is (3S,6R)-6-methyldecan-3-amine.

Molecular Properties

Compound Name(3S,6R)-6-methyldecan-3-amine
PubChem CID88893264
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name(3S,6R)-6-methyldecan-3-amine
SMILESCCCC[C@@H](C)CC[C@@H](N)CC
InChIInChI=1S/C11H25N/c1-4-6-7-10(3)8-9-11(12)5-2/h10-11H,4-9,12H2,1-3H3/t10-,11+/m1/s1
InChIKeyKLJLECHUMGMPSB-MNOVXSKESA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
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

4,10-dimethyltetradecan-7-amine
CID 167136047
6-methylnonan-3-amine
CID 62266250
2,7-dimethylundecan-4-amine
CID 20767200
(3R,6S)-3,6-dimethyldecane
CID 170848353
3-ethyl-6-methyldecane
CID 57490928
tridecan-3-amine
CID 19435959
5,7,10-trimethyltetradecane
CID 91033593
5,8,18,24-tetramethylhentriacontane
CID 6430103
tetradecane-3,6,9,12-tetramine
CID 140993886
tritriactan-3-amine;hydrochloride
CID 173389490
tetradecan-3-amine;hydrobromide
CID 173393490
3,11-dimethylpentadecane
CID 58340720

Frequently Asked Questions

What is the IUPAC name of (3S,6R)-6-methyldecan-3-amine?
The IUPAC name of (3S,6R)-6-methyldecan-3-amine (CID 88893264) is (3S,6R)-6-methyldecan-3-amine.
What is the SMILES notation for (3S,6R)-6-methyldecan-3-amine?
The canonical SMILES for (3S,6R)-6-methyldecan-3-amine is CCCC[C@@H](C)CC[C@@H](N)CC.
What is the InChIKey of (3S,6R)-6-methyldecan-3-amine?
The InChIKey is KLJLECHUMGMPSB-MNOVXSKESA-N. The full InChI is InChI=1S/C11H25N/c1-4-6-7-10(3)8-9-11(12)5-2/h10-11H,4-9,12H2,1-3H3/t10-,11+/m1/s1.
What are the key properties of (3S,6R)-6-methyldecan-3-amine?
(3S,6R)-6-methyldecan-3-amine has a molecular weight of 171.33 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,6R)-6-methyldecan-3-amine is sourced from PubChem (CID 88893264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).