N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide

C11H21N3O2 — CID 114761074

IUPACN-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide
SMILESCN(CC(=O)NC1CC1)CC1(O)CCNC1
InChIInChI=1S/C11H21N3O2/c1-14(6-10(15)13-9-2-3-9)8-11(16)4-5-12-7-11/h9,12,16H,2-8H2,1H3,(H,13,15)
InChIKeyLRSWEROJPCWAIW-UHFFFAOYSA-N
MW227.31 g/mol
LogP-1.08
Rot. Bonds5

About N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide

N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide (PubChem CID 114761074) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide
PubChem CID114761074
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide
SMILESCN(CC(=O)NC1CC1)CC1(O)CCNC1
InChIInChI=1S/C11H21N3O2/c1-14(6-10(15)13-9-2-3-9)8-11(16)4-5-12-7-11/h9,12,16H,2-8H2,1H3,(H,13,15)
InChIKeyLRSWEROJPCWAIW-UHFFFAOYSA-N
XLogP-1.08
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-1.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]-N-(2-methylbutan-2-yl)acetamide
CID 114761399
N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide
CID 115758301
4-[[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]methyl]-4-hydroxycyclohexane-1-carboxylic acid
CID 106498637
N-butan-2-yl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide
CID 114761300
3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]propanamide
CID 60700103
2-[cyanomethyl(methyl)amino]-N-cyclopropylacetamide
CID 60677002
3-[[3-hydroxybutyl(methyl)amino]methyl]pyrrolidin-3-ol
CID 114761156
2-(dimethylamino)-N-(1-oxa-4-azaspiro[5.5]undecan-9-yl)acetamide
CID 165476665
N-cyclopropyl-2-[methyl-(2-oxo-2-piperazin-1-ylethyl)amino]acetamide;hydrochloride
CID 119914949
N-cyclopentyl-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79717424
N-cyclopropyl-2-[methyl(prop-2-ynyl)amino]acetamide
CID 60670124
N-cyclopropyl-3-(3-methylpiperidin-3-yl)oxypropanamide
CID 107385799

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide (CID 114761074) is N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide is CN(CC(=O)NC1CC1)CC1(O)CCNC1.
What is the InChIKey of N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide?
The InChIKey is LRSWEROJPCWAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-14(6-10(15)13-9-2-3-9)8-11(16)4-5-12-7-11/h9,12,16H,2-8H2,1H3,(H,13,15).
What are the key properties of N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide?
N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide has a molecular weight of 227.31 g/mol, XLogP of -1.08, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide is sourced from PubChem (CID 114761074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).