(2S)-4-(cyclopropylmethyl)-2-methylmorpholine

C9H17NO — CID 126997492

IUPAC(2S)-4-(cyclopropylmethyl)-2-methylmorpholine
SMILESC[C@H]1CN(CC2CC2)CCO1
InChIInChI=1S/C9H17NO/c1-8-6-10(4-5-11-8)7-9-2-3-9/h8-9H,2-7H2,1H3/t8-/m0/s1
InChIKeyRZNUSHROXRZVLV-QMMMGPOBSA-N
MW155.24 g/mol
LogP1.12
Rot. Bonds2

About (2S)-4-(cyclopropylmethyl)-2-methylmorpholine

(2S)-4-(cyclopropylmethyl)-2-methylmorpholine (PubChem CID 126997492) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (2S)-4-(cyclopropylmethyl)-2-methylmorpholine.

Molecular Properties

Compound Name(2S)-4-(cyclopropylmethyl)-2-methylmorpholine
PubChem CID126997492
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(2S)-4-(cyclopropylmethyl)-2-methylmorpholine
SMILESC[C@H]1CN(CC2CC2)CCO1
InChIInChI=1S/C9H17NO/c1-8-6-10(4-5-11-8)7-9-2-3-9/h8-9H,2-7H2,1H3/t8-/m0/s1
InChIKeyRZNUSHROXRZVLV-QMMMGPOBSA-N
XLogP1.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-4-(cyclopropylmethyl)-2-methylmorpholine?
The IUPAC name of (2S)-4-(cyclopropylmethyl)-2-methylmorpholine (CID 126997492) is (2S)-4-(cyclopropylmethyl)-2-methylmorpholine.
What is the SMILES notation for (2S)-4-(cyclopropylmethyl)-2-methylmorpholine?
The canonical SMILES for (2S)-4-(cyclopropylmethyl)-2-methylmorpholine is C[C@H]1CN(CC2CC2)CCO1.
What is the InChIKey of (2S)-4-(cyclopropylmethyl)-2-methylmorpholine?
The InChIKey is RZNUSHROXRZVLV-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H17NO/c1-8-6-10(4-5-11-8)7-9-2-3-9/h8-9H,2-7H2,1H3/t8-/m0/s1.
What are the key properties of (2S)-4-(cyclopropylmethyl)-2-methylmorpholine?
(2S)-4-(cyclopropylmethyl)-2-methylmorpholine has a molecular weight of 155.24 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-(cyclopropylmethyl)-2-methylmorpholine is sourced from PubChem (CID 126997492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).