N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide

C14H26N4O2 — CID 63267509

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
SMILESCNCC1CCN(CC(=O)N(C)CC(=O)NC2CC2)C1
InChIInChI=1S/C14H26N4O2/c1-15-7-11-5-6-18(8-11)10-14(20)17(2)9-13(19)16-12-3-4-12/h11-12,15H,3-10H2,1-2H3,(H,16,19)
InChIKeyNNFAVSKTANBASA-UHFFFAOYSA-N
MW282.39 g/mol
LogP-0.74
Rot. Bonds7

About N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide

N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide (PubChem CID 63267509) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
PubChem CID63267509
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
SMILESCNCC1CCN(CC(=O)N(C)CC(=O)NC2CC2)C1
InChIInChI=1S/C14H26N4O2/c1-15-7-11-5-6-18(8-11)10-14(20)17(2)9-13(19)16-12-3-4-12/h11-12,15H,3-10H2,1-2H3,(H,16,19)
InChIKeyNNFAVSKTANBASA-UHFFFAOYSA-N
XLogP-0.74
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide
CID 62356308
2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 81451259
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-piperazin-1-ylacetamide
CID 43162383
2-[4-(1-aminoethyl)piperidin-1-yl]-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 63595362
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 63248834
N-(cyclopropylcarbamoyl)-2-[3-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119914633
N-ethyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 63264164
N-cyclohexyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922360
N-tert-butyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119922204
2-(4-amino-2-methylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 115313084
2-[3-(methylaminomethyl)pyrrolidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 63267736
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-3-oxobutanamide
CID 43579629

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide (CID 63267509) is N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide is CNCC1CCN(CC(=O)N(C)CC(=O)NC2CC2)C1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide?
The InChIKey is NNFAVSKTANBASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-15-7-11-5-6-18(8-11)10-14(20)17(2)9-13(19)16-12-3-4-12/h11-12,15H,3-10H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide has a molecular weight of 282.39 g/mol, XLogP of -0.74, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 63267509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).