tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate

C15H30N2O3 — CID 134964541

IUPACtert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate
SMILESCC[C@H](C)C(CN1CCOCC1)NC(=O)OC(C)(C)C
InChIInChI=1S/C15H30N2O3/c1-6-12(2)13(11-17-7-9-19-10-8-17)16-14(18)20-15(3,4)5/h12-13H,6-11H2,1-5H3,(H,16,18)/t12-,13?/m0/s1
InChIKeyFOGNMBXQSWZJNR-UEWDXFNNSA-N
MW286.42 g/mol
LogP2.26
Rot. Bonds5

About tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate

tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate (PubChem CID 134964541) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate
PubChem CID134964541
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Nametert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate
SMILESCC[C@H](C)C(CN1CCOCC1)NC(=O)OC(C)(C)C
InChIInChI=1S/C15H30N2O3/c1-6-12(2)13(11-17-7-9-19-10-8-17)16-14(18)20-15(3,4)5/h12-13H,6-11H2,1-5H3,(H,16,18)/t12-,13?/m0/s1
InChIKeyFOGNMBXQSWZJNR-UEWDXFNNSA-N
XLogP2.26
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[1-(piperidin-4-yl)ethyl]carbamate
CID 43523185
tert-butyl N-((3-methylpiperidin-2-yl)methyl)carbamate
CID 63305138
tert-butyl N-(2-{[2-(morpholin-4-yl)ethyl]amino}ethyl)carbamate
CID 19420463
Carbamic acid, (3-morpholinylmethyl)-, 1,1-dimethylethyl ester
CID 19691327
tert-butyl N-((3S,5S)-5-methylpiperidin-3-yl)carbamate
CID 24757764
tert-Butyl 4-[(2-methoxyethyl)amino]piperidine-1-carboxylate
CID 43652134
Tert-butyl 3-(methoxymethyl)piperazine-1-carboxylate
CID 57886914
(S)-Tert-butyl 3-(methoxymethyl)piperazine-1-carboxylate
CID 57960204
tert-butyl N-methyl-N-((3R,4R)-4-methylpiperidin-3-yl)carbamate
CID 58332169
(R)-tert-Butyl 3-(methoxymethyl)piperazine-1-carboxylate
CID 66577080
Tert-butyl 3-((methylamino)methyl)morpholine-4-carboxylate
CID 67090612
Tert-butyl 3-amino-4-methylpiperidine-1-carboxylate
CID 67971847

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate?
The IUPAC name of tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate (CID 134964541) is tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate.
What is the SMILES notation for tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate?
The canonical SMILES for tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate is CC[C@H](C)C(CN1CCOCC1)NC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate?
The InChIKey is FOGNMBXQSWZJNR-UEWDXFNNSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-6-12(2)13(11-17-7-9-19-10-8-17)16-14(18)20-15(3,4)5/h12-13H,6-11H2,1-5H3,(H,16,18)/t12-,13?/m0/s1.
What are the key properties of tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate?
tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate has a molecular weight of 286.42 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(3S)-3-methyl-1-morpholin-4-ylpentan-2-yl]carbamate is sourced from PubChem (CID 134964541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).