N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide

C10H18N4O2 — CID 107975606

IUPACN-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide
SMILESCOCCN(CCN)C(=O)c1cn(C)cn1
InChIInChI=1S/C10H18N4O2/c1-13-7-9(12-8-13)10(15)14(4-3-11)5-6-16-2/h7-8H,3-6,11H2,1-2H3
InChIKeyVUTCJXOMFVHUSE-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.53
Rot. Bonds6

About N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide

N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide (PubChem CID 107975606) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide
PubChem CID107975606
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC NameN-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide
SMILESCOCCN(CCN)C(=O)c1cn(C)cn1
InChIInChI=1S/C10H18N4O2/c1-13-7-9(12-8-13)10(15)14(4-3-11)5-6-16-2/h7-8H,3-6,11H2,1-2H3
InChIKeyVUTCJXOMFVHUSE-UHFFFAOYSA-N
XLogP-0.53
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-aminoethyl)-N-cyclopentyl-1-methylimidazole-4-carboxamide
CID 107970866
4-methoxy-1-(1-methylimidazol-4-yl)butan-1-one
CID 107977511
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylimidazole-4-carboxamide
CID 103803952
N-(3-aminopropyl)-N-(4-methoxyphenyl)-1-methylimidazole-4-carboxamide
CID 107970800
methyl 2-[methyl-(1-methylimidazole-4-carbonyl)amino]acetate
CID 103858595
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-1-methylimidazole-4-carboxamide
CID 107975497
N-(2-bromoethyl)-N-(2-methoxyethyl)-1-methylpyrazole-3-carboxamide
CID 103122847
N-[(E)-4-aminobut-2-enyl]-1-methylimidazole-4-carboxamide
CID 107973594
N-(cyclopropylmethyl)-1-methylimidazole-4-carboxamide
CID 130626722
N-(2-aminoethyl)-N-(2-methoxyethyl)-6-oxo-1H-pyridine-2-carboxamide
CID 114040542
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-1-methylimidazole-4-carboxamide
CID 107970828
1-(azetidin-3-yl)-N,N-bis(2-methoxyethyl)triazole-4-carboxamide
CID 79317057

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide?
The IUPAC name of N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide (CID 107975606) is N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide is COCCN(CCN)C(=O)c1cn(C)cn1.
What is the InChIKey of N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide?
The InChIKey is VUTCJXOMFVHUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-13-7-9(12-8-13)10(15)14(4-3-11)5-6-16-2/h7-8H,3-6,11H2,1-2H3.
What are the key properties of N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide?
N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide has a molecular weight of 226.28 g/mol, XLogP of -0.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-(2-methoxyethyl)-1-methylimidazole-4-carboxamide is sourced from PubChem (CID 107975606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).