1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine

C15H25N3OS — CID 129343555

IUPAC1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine
SMILESCc1csc(CN2CCO[C@@H](CN(C)CC3CC3)C2)n1
InChIInChI=1S/C15H25N3OS/c1-12-11-20-15(16-12)10-18-5-6-19-14(9-18)8-17(2)7-13-3-4-13/h11,13-14H,3-10H2,1-2H3/t14-/m0/s1
InChIKeyWZCUIANUMRJSJL-AWEZNQCLSA-N
MW295.45 g/mol
LogP1.99
Rot. Bonds6

About 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine

1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine (PubChem CID 129343555) has the molecular formula C15H25N3OS and a molecular weight of 295.45 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine
PubChem CID129343555
Molecular FormulaC15H25N3OS
Molecular Weight295.45 g/mol
Exact Mass295.17
IUPAC Name1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine
SMILESCc1csc(CN2CCO[C@@H](CN(C)CC3CC3)C2)n1
InChIInChI=1S/C15H25N3OS/c1-12-11-20-15(16-12)10-18-5-6-19-14(9-18)8-17(2)7-13-3-4-13/h11,13-14H,3-10H2,1-2H3/t14-/m0/s1
InChIKeyWZCUIANUMRJSJL-AWEZNQCLSA-N
XLogP1.99
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopropyl-N-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]morpholin-2-yl]methyl]-N-methylmethanamine
CID 128996868
(5aS,8aS)-4-(cyclopropylmethyl)-7-[(4-methyl-1,3-thiazol-2-yl)methyl]-3,5,5a,6,8,8a-hexahydro-2H-pyrrolo[3,4-f][1,4]oxazepine
CID 97474993
1-cyclopropyl-N-methyl-N-[[(2S)-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]morpholin-2-yl]methyl]methanamine
CID 129338754
1-cyclopropyl-N-methyl-N-[[(2R)-4-[(1-methylpyrrol-3-yl)methyl]morpholin-2-yl]methyl]methanamine
CID 129343784
[5-[[(2S)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]methyl]furan-2-yl]methanol
CID 129344343
2-[(3-bromopiperidin-1-yl)methyl]-4-methyl-1,3-thiazole
CID 80680098
2-(3,9-diazabicyclo[4.2.1]nonan-3-ylmethyl)-4-methyl-1,3-thiazole
CID 115314298
1-[4-[(2-cyclopentyl-1,3-thiazol-4-yl)methyl]morpholin-2-yl]-N,N-dimethylmethanamine
CID 56781129
1-[(2R)-4-[(2-cyclopentyl-1,3-thiazol-4-yl)methyl]morpholin-2-yl]-N,N-dimethylmethanamine
CID 95611811
(2R)-4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
CID 97320286
[(2S)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]-(6-methyl-2-pyridinyl)methanone
CID 129336719
[(4aR,8aR)-6-[(4-methyl-1,3-thiazol-2-yl)methyl]-3,4a,5,7,8,8a-hexahydro-2H-pyrido[4,3-b][1,4]oxazin-4-yl]-pyridin-4-ylmethanone
CID 124800795

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine (CID 129343555) is 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine is Cc1csc(CN2CCO[C@@H](CN(C)CC3CC3)C2)n1.
What is the InChIKey of 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine?
The InChIKey is WZCUIANUMRJSJL-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H25N3OS/c1-12-11-20-15(16-12)10-18-5-6-19-14(9-18)8-17(2)7-13-3-4-13/h11,13-14H,3-10H2,1-2H3/t14-/m0/s1.
What are the key properties of 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine?
1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine has a molecular weight of 295.45 g/mol, XLogP of 1.99, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-N-[[(2S)-4-[(4-methyl-1,3-thiazol-2-yl)methyl]morpholin-2-yl]methyl]methanamine is sourced from PubChem (CID 129343555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).