N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide

C11H21N3O2 — CID 43567877

IUPACN-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
SMILESCC(C)NC(=O)CNCC(=O)NCC1CC1
InChIInChI=1S/C11H21N3O2/c1-8(2)14-11(16)7-12-6-10(15)13-5-9-3-4-9/h8-9,12H,3-7H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyJLIRNVAGXHSZNU-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.37
Rot. Bonds7

About N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide

N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide (PubChem CID 43567877) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
PubChem CID43567877
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
SMILESCC(C)NC(=O)CNCC(=O)NCC1CC1
InChIInChI=1S/C11H21N3O2/c1-8(2)14-11(16)7-12-6-10(15)13-5-9-3-4-9/h8-9,12H,3-7H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyJLIRNVAGXHSZNU-UHFFFAOYSA-N
XLogP-0.37
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 28566205
N-(cyclopropylmethyl)-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
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N-(cyclopropylmethyl)-2-[(3-hydroxy-2-methylpropyl)amino]acetamide
CID 65035969
N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide
CID 54880897
N-cyclopentyl-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 43402010
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CID 60841587
2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide
CID 66005704
2-(cyclopropylmethylamino)-N-[(1-methylpiperidin-4-yl)methyl]acetamide;dihydrochloride
CID 119866901
2-(cyclobutylmethylamino)-N-(3-methylbutan-2-yl)acetamide
CID 61489134
N-(cyclopropylmethyl)-2-[(1-methylcyclopentyl)methylamino]acetamide
CID 63821683
N-(cyclopropylmethyl)-2-[(2-methylcyclopentyl)methylamino]acetamide
CID 107418293
2-(cyclopropylmethylamino)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide
CID 119730358

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide (CID 43567877) is N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide is CC(C)NC(=O)CNCC(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide?
The InChIKey is JLIRNVAGXHSZNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(2)14-11(16)7-12-6-10(15)13-5-9-3-4-9/h8-9,12H,3-7H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide?
N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide has a molecular weight of 227.31 g/mol, XLogP of -0.37, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide is sourced from PubChem (CID 43567877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).