benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate

C19H29N3O3 — CID 59510483

IUPACbenzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate
SMILESO=C(NCC1CN(CC2CCNCC2)CCO1)OCc1ccccc1
InChIInChI=1S/C19H29N3O3/c23-19(25-15-17-4-2-1-3-5-17)21-12-18-14-22(10-11-24-18)13-16-6-8-20-9-7-16/h1-5,16,18,20H,6-15H2,(H,21,23)
InChIKeyZGAUBBKQPAOHPJ-UHFFFAOYSA-N
MW347.46 g/mol
LogP1.61
Rot. Bonds6

About benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate

benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate (PubChem CID 59510483) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate.

Molecular Properties

Compound Namebenzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate
PubChem CID59510483
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Namebenzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate
SMILESO=C(NCC1CN(CC2CCNCC2)CCO1)OCc1ccccc1
InChIInChI=1S/C19H29N3O3/c23-19(25-15-17-4-2-1-3-5-17)21-12-18-14-22(10-11-24-18)13-16-6-8-20-9-7-16/h1-5,16,18,20H,6-15H2,(H,21,23)
InChIKeyZGAUBBKQPAOHPJ-UHFFFAOYSA-N
XLogP1.61
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzyl N-[[(2R)-morpholin-2-yl]methyl]carbamate
CID 53338708
benzyl N-(azepan-4-ylmethyl)carbamate;hydrochloride
CID 118798557
benzyl N-(morpholin-2-ylmethyl)carbamate;tert-butyl 2-(phenylmethoxycarbonylaminomethyl)morpholine-4-carboxylate;dihydrochloride
CID 160880522
benzyl N-(cyclopropylmethyl)carbamate
CID 53419264
benzyl N-(piperidin-4-ylmethyl)carbamate;tert-butyl 2-[4-(phenylmethoxycarbonylaminomethyl)piperidin-1-yl]acetate;methane
CID 159207468
benzyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]cyclobutyl]carbamate
CID 103393813
(4-benzylmorpholin-2-yl)methylcarbamic acid
CID 21104645
tert-butyl N-[(4-benzylmorpholin-2-yl)methyl]carbamate;tert-butyl N-(morpholin-2-ylmethyl)carbamate
CID 159216706
benzyl N-[2-(4-piperidin-4-ylpiperidin-1-yl)ethyl]carbamate
CID 167312043
(2R)-N-[(4-benzylmorpholin-2-yl)methyl]piperidine-2-carboxamide
CID 119829812
2-[(3S)-3-(phenylmethoxycarbonylaminomethyl)pyrrolidin-1-yl]acetic acid
CID 96554065
2-[3-(phenylmethoxycarbonylaminomethyl)pyrrolidin-1-yl]acetic acid
CID 66566865

Frequently Asked Questions

What is the IUPAC name of benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate?
The IUPAC name of benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate (CID 59510483) is benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate.
What is the SMILES notation for benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate?
The canonical SMILES for benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate is O=C(NCC1CN(CC2CCNCC2)CCO1)OCc1ccccc1.
What is the InChIKey of benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate?
The InChIKey is ZGAUBBKQPAOHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c23-19(25-15-17-4-2-1-3-5-17)21-12-18-14-22(10-11-24-18)13-16-6-8-20-9-7-16/h1-5,16,18,20H,6-15H2,(H,21,23).
What are the key properties of benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate?
benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate has a molecular weight of 347.46 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[[4-(piperidin-4-ylmethyl)morpholin-2-yl]methyl]carbamate is sourced from PubChem (CID 59510483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).