2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate

C10H19N3O4 — CID 79346332

IUPAC2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate
SMILESNC(=O)CN1CCC(NC(=O)OCCO)CC1
InChIInChI=1S/C10H19N3O4/c11-9(15)7-13-3-1-8(2-4-13)12-10(16)17-6-5-14/h8,14H,1-7H2,(H2,11,15)(H,12,16)
InChIKeySMTDLBTUUGUOCU-UHFFFAOYSA-N
MW245.28 g/mol
LogP-1.35
Rot. Bonds5

About 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate

2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate (PubChem CID 79346332) has the molecular formula C10H19N3O4 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate
PubChem CID79346332
Molecular FormulaC10H19N3O4
Molecular Weight245.28 g/mol
Exact Mass245.14
IUPAC Name2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate
SMILESNC(=O)CN1CCC(NC(=O)OCCO)CC1
InChIInChI=1S/C10H19N3O4/c11-9(15)7-13-3-1-8(2-4-13)12-10(16)17-6-5-14/h8,14H,1-7H2,(H2,11,15)(H,12,16)
InChIKeySMTDLBTUUGUOCU-UHFFFAOYSA-N
XLogP-1.35
TPSA104.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 5-1.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-hydroxyethyl N-(1-butylpiperidin-4-yl)carbamate
CID 79345508
2-[4-[(2-chloroacetyl)amino]piperidin-1-yl]acetamide
CID 43425925
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide
CID 60868376
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]prop-2-enamide
CID 43700635
2-hydroxyethyl N-(1-ethylpiperidin-3-yl)carbamate
CID 79348890
2-hydroxyethyl N-(4-propylcyclohexyl)carbamate
CID 79349163
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-chloro-2,2-dimethylpropanamide
CID 63680196
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(tert-butylamino)acetamide
CID 49487861
4-hydroxybutyl N-(1-benzylpiperidin-4-yl)carbamate
CID 15676953
2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 74958986
tert-butyl N-[1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]piperidin-4-yl]carbamate
CID 156865630
2-[7-(2-amino-2-oxoethyl)-4,10-bis(2-hydroxyethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 101001022

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate?
The IUPAC name of 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate (CID 79346332) is 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate.
What is the SMILES notation for 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate?
The canonical SMILES for 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate is NC(=O)CN1CCC(NC(=O)OCCO)CC1.
What is the InChIKey of 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate?
The InChIKey is SMTDLBTUUGUOCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O4/c11-9(15)7-13-3-1-8(2-4-13)12-10(16)17-6-5-14/h8,14H,1-7H2,(H2,11,15)(H,12,16).
What are the key properties of 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate?
2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate has a molecular weight of 245.28 g/mol, XLogP of -1.35, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamate is sourced from PubChem (CID 79346332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).