3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide

C17H30N2O2 — CID 129331809

IUPAC3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
SMILESCN1CCO[C@H](CN(CC2CC2)C(=O)CCC2CCC2)C1
InChIInChI=1S/C17H30N2O2/c1-18-9-10-21-16(12-18)13-19(11-15-5-6-15)17(20)8-7-14-3-2-4-14/h14-16H,2-13H2,1H3/t16-/m0/s1
InChIKeyCMIXRSODDYPVFC-INIZCTEOSA-N
MW294.44 g/mol
LogP2.14
Rot. Bonds7

About 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide

3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide (PubChem CID 129331809) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide.

Molecular Properties

Compound Name3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
PubChem CID129331809
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
SMILESCN1CCO[C@H](CN(CC2CC2)C(=O)CCC2CCC2)C1
InChIInChI=1S/C17H30N2O2/c1-18-9-10-21-16(12-18)13-19(11-15-5-6-15)17(20)8-7-14-3-2-4-14/h14-16H,2-13H2,1H3/t16-/m0/s1
InChIKeyCMIXRSODDYPVFC-INIZCTEOSA-N
XLogP2.14
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide?
The IUPAC name of 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide (CID 129331809) is 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide.
What is the SMILES notation for 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide?
The canonical SMILES for 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide is CN1CCO[C@H](CN(CC2CC2)C(=O)CCC2CCC2)C1.
What is the InChIKey of 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide?
The InChIKey is CMIXRSODDYPVFC-INIZCTEOSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-18-9-10-21-16(12-18)13-19(11-15-5-6-15)17(20)8-7-14-3-2-4-14/h14-16H,2-13H2,1H3/t16-/m0/s1.
What are the key properties of 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide?
3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide has a molecular weight of 294.44 g/mol, XLogP of 2.14, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide is sourced from PubChem (CID 129331809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).