4-[(3S)-3-methylpentyl]morpholine

C10H21NO — CID 167092878

IUPAC4-[(3S)-3-methylpentyl]morpholine
SMILESCC[C@H](C)CCN1CCOCC1
InChIInChI=1S/C10H21NO/c1-3-10(2)4-5-11-6-8-12-9-7-11/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyVJHKPBNIIOLMMB-JTQLQIEISA-N
MW171.28 g/mol
LogP1.75
Rot. Bonds4

About 4-[(3S)-3-methylpentyl]morpholine

4-[(3S)-3-methylpentyl]morpholine (PubChem CID 167092878) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-[(3S)-3-methylpentyl]morpholine.

Molecular Properties

Compound Name4-[(3S)-3-methylpentyl]morpholine
PubChem CID167092878
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-[(3S)-3-methylpentyl]morpholine
SMILESCC[C@H](C)CCN1CCOCC1
InChIInChI=1S/C10H21NO/c1-3-10(2)4-5-11-6-8-12-9-7-11/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyVJHKPBNIIOLMMB-JTQLQIEISA-N
XLogP1.75
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-4-morpholin-4-ylbutan-1-amine
CID 81080457
ethane;4-(2-methylbutyl)morpholine
CID 142525427
4-morpholin-4-yl-N,N-di(propan-2-yl)butan-2-amine
CID 174780048
1-(3-methylpentyl)piperazine
CID 45099566
4-(4-methylnonyl)morpholine
CID 170444016
4,4-dimethyl-1-morpholin-4-ylpentan-3-ol
CID 62622858
4-methyl-6-morpholin-4-ylhexan-3-one
CID 79416722
4-morpholin-4-ylbutane-1,2-diamine
CID 154463097
ethane;4-propylmorpholine
CID 143004992
16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71337150
4-propylmorpholine;hydrobromide
CID 70540609
2-methyl-N'-(2-morpholin-4-ylethyl)butane-1,4-diamine
CID 114987350

Frequently Asked Questions

What is the IUPAC name of 4-[(3S)-3-methylpentyl]morpholine?
The IUPAC name of 4-[(3S)-3-methylpentyl]morpholine (CID 167092878) is 4-[(3S)-3-methylpentyl]morpholine.
What is the SMILES notation for 4-[(3S)-3-methylpentyl]morpholine?
The canonical SMILES for 4-[(3S)-3-methylpentyl]morpholine is CC[C@H](C)CCN1CCOCC1.
What is the InChIKey of 4-[(3S)-3-methylpentyl]morpholine?
The InChIKey is VJHKPBNIIOLMMB-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21NO/c1-3-10(2)4-5-11-6-8-12-9-7-11/h10H,3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of 4-[(3S)-3-methylpentyl]morpholine?
4-[(3S)-3-methylpentyl]morpholine has a molecular weight of 171.28 g/mol, XLogP of 1.75, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3S)-3-methylpentyl]morpholine is sourced from PubChem (CID 167092878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).