2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone

C14H26N2O2 — CID 97091659

IUPAC2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone
SMILESCC(C)N(CC(=O)N1CCOCC1)C[C@@H]1C[C@@H]1C
InChIInChI=1S/C14H26N2O2/c1-11(2)16(9-13-8-12(13)3)10-14(17)15-4-6-18-7-5-15/h11-13H,4-10H2,1-3H3/t12-,13-/m0/s1
InChIKeyMPZXUVWVIKUCAT-STQMWFEESA-N
MW254.37 g/mol
LogP1.21
Rot. Bonds5

About 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone

2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone (PubChem CID 97091659) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone
PubChem CID97091659
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone
SMILESCC(C)N(CC(=O)N1CCOCC1)C[C@@H]1C[C@@H]1C
InChIInChI=1S/C14H26N2O2/c1-11(2)16(9-13-8-12(13)3)10-14(17)15-4-6-18-7-5-15/h11-13H,4-10H2,1-3H3/t12-,13-/m0/s1
InChIKeyMPZXUVWVIKUCAT-STQMWFEESA-N
XLogP1.21
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methylcyclopropyl)methyl-propan-2-ylamino]-1-(4-methylpiperazin-1-yl)ethanone
CID 84595704
2-[methyl-[[(1R,3R)-3-methylcyclopentyl]methyl]amino]-1-morpholin-4-ylethanone
CID 124864588
1-(2-methylmorpholin-4-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]ethanone
CID 79705094
1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone
CID 106614579
formaldehyde;3-methyl-1-morpholin-4-ylbutan-1-one
CID 143869951
2-[3-hydroxypropyl(propan-2-yl)amino]-1-(4-methylpiperidin-1-yl)ethanone
CID 62020113
3-[[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-propan-2-ylamino]propanoic acid
CID 60834885
4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one
CID 166717167
4-[[2-(2-methylmorpholin-4-yl)-2-oxoethyl]-propan-2-ylamino]butanoic acid
CID 60834906
3-[tert-butyl-(2-morpholin-4-yl-2-oxoethyl)amino]-2-methylpropanoic acid
CID 82326955
2-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]-1-morpholin-4-ylethanone
CID 56784565
N-(2-aminoethyl)-N-propan-2-ylmorpholine-4-carboxamide
CID 79155314

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone (CID 97091659) is 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone is CC(C)N(CC(=O)N1CCOCC1)C[C@@H]1C[C@@H]1C.
What is the InChIKey of 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone?
The InChIKey is MPZXUVWVIKUCAT-STQMWFEESA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11(2)16(9-13-8-12(13)3)10-14(17)15-4-6-18-7-5-15/h11-13H,4-10H2,1-3H3/t12-,13-/m0/s1.
What are the key properties of 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone?
2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone has a molecular weight of 254.37 g/mol, XLogP of 1.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R,2S)-2-methylcyclopropyl]methyl-propan-2-ylamino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 97091659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).