2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate

C17H26N2O3 — CID 23275932

IUPAC2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate
SMILESCC(C)Oc1cccc(NC(=O)OCCN2CCCCC2)c1
InChIInChI=1S/C17H26N2O3/c1-14(2)22-16-8-6-7-15(13-16)18-17(20)21-12-11-19-9-4-3-5-10-19/h6-8,13-14H,3-5,9-12H2,1-2H3,(H,18,20)
InChIKeyULOAZZQOTVKFRA-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.51
Rot. Bonds6

About 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate

2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate (PubChem CID 23275932) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate.

Molecular Properties

Compound Name2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate
PubChem CID23275932
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate
SMILESCC(C)Oc1cccc(NC(=O)OCCN2CCCCC2)c1
InChIInChI=1S/C17H26N2O3/c1-14(2)22-16-8-6-7-15(13-16)18-17(20)21-12-11-19-9-4-3-5-10-19/h6-8,13-14H,3-5,9-12H2,1-2H3,(H,18,20)
InChIKeyULOAZZQOTVKFRA-UHFFFAOYSA-N
XLogP3.51
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azepan-1-yl)-N-(3-propan-2-yloxyphenyl)acetamide
CID 54814466
2-piperidin-1-ylethyl N-(3-phenylmethoxyphenyl)carbamate;hydrochloride
CID 138398426
3-piperidin-1-ylpropyl N-(3-nonoxyphenyl)carbamate
CID 15937470
2-piperidin-1-ylethyl N-(3-chloro-4-methylphenyl)carbamate;hydrochloride
CID 138398474
(2-hydroxy-3-piperidin-1-ylpropyl) N-(3-butoxyphenyl)carbamate;hydrochloride
CID 24836360
2-piperidin-1-ylethyl N-(4-acetylphenyl)carbamate;hydrochloride
CID 45048307
2-amino-N-(3-propan-2-yloxyphenyl)acetamide
CID 39242033
2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide
CID 75375647
2-morpholin-4-ylethyl N-(3-nonoxyphenyl)carbamate;hydrochloride
CID 3087063
(2R)-2-amino-N-[3-(3-piperidin-1-ylpropanoylamino)phenyl]propanamide
CID 119883310
1,3-di(piperidin-1-yl)propan-2-yl N-(3-butoxyphenyl)carbamate
CID 3087334
2-hydroxyethyl N-[3-(pyrrolidin-1-ylmethyl)phenyl]carbamate
CID 79345593

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate?
The IUPAC name of 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate (CID 23275932) is 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate.
What is the SMILES notation for 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate?
The canonical SMILES for 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate is CC(C)Oc1cccc(NC(=O)OCCN2CCCCC2)c1.
What is the InChIKey of 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate?
The InChIKey is ULOAZZQOTVKFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-14(2)22-16-8-6-7-15(13-16)18-17(20)21-12-11-19-9-4-3-5-10-19/h6-8,13-14H,3-5,9-12H2,1-2H3,(H,18,20).
What are the key properties of 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate?
2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate has a molecular weight of 306.41 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate is sourced from PubChem (CID 23275932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).