N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide

C11H23N5O — CID 59766508

IUPACN-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide
SMILESCC(C)(C(=O)NCCN)C1=NCCN1CCN
InChIInChI=1S/C11H23N5O/c1-11(2,10(17)15-5-3-12)9-14-6-8-16(9)7-4-13/h3-8,12-13H2,1-2H3,(H,15,17)
InChIKeyNKOSOTVCKAHSRS-UHFFFAOYSA-N
MW241.34 g/mol
LogP-1.24
Rot. Bonds6

About N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide

N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide (PubChem CID 59766508) has the molecular formula C11H23N5O and a molecular weight of 241.34 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide
PubChem CID59766508
Molecular FormulaC11H23N5O
Molecular Weight241.34 g/mol
Exact Mass241.19
IUPAC NameN-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide
SMILESCC(C)(C(=O)NCCN)C1=NCCN1CCN
InChIInChI=1S/C11H23N5O/c1-11(2,10(17)15-5-3-12)9-14-6-8-16(9)7-4-13/h3-8,12-13H2,1-2H3,(H,15,17)
InChIKeyNKOSOTVCKAHSRS-UHFFFAOYSA-N
XLogP-1.24
TPSA96.74 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 5-1.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-Diethylamino-2,3,6,7-tetrahydro-1h-1,4-diazepin-7-one
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N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide
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2-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylacetamide
CID 54336256
N-(ethylaminomethyl)-2-(1-ethyl-4,5-dihydroimidazol-2-yl)-2-methylpropanamide
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N-[2-[2-(2-aminoethylamino)ethylamino]ethyl]-2-[1-[2-(2-aminoethylamino)ethyl]-4,5-dihydroimidazol-2-yl]acetamide
CID 59846977
CID 60002811
CID 60002811
N-[2-(3-ethyl-2-propan-2-yl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]-2-methylpropanamide
CID 117780109
2-methyl-N-[2-(3-methyl-2-propan-2-yl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]propanamide
CID 117780393
N-[2-(2-ethyl-3-methyl-4,5-dihydroimidazol-3-ium-1-yl)ethyl]propanamide
CID 117780494
N-[2-(2-ethyl-4,5-dihydroimidazol-1-yl)ethyl]propanamide
CID 126493196
N-[2-(1,2-diethyl-4,5-dihydroimidazol-1-ium-1-yl)ethyl]acetamide
CID 138507515
1,2-Dimethyl-5-(piperazin-1-ylmethyl)-4,5-dihydropyrimidin-6-one
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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide?
The IUPAC name of N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide (CID 59766508) is N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide.
What is the SMILES notation for N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide?
The canonical SMILES for N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide is CC(C)(C(=O)NCCN)C1=NCCN1CCN.
What is the InChIKey of N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide?
The InChIKey is NKOSOTVCKAHSRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5O/c1-11(2,10(17)15-5-3-12)9-14-6-8-16(9)7-4-13/h3-8,12-13H2,1-2H3,(H,15,17).
What are the key properties of N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide?
N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide has a molecular weight of 241.34 g/mol, XLogP of -1.24, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-[1-(2-aminoethyl)-4,5-dihydroimidazol-2-yl]-2-methylpropanamide is sourced from PubChem (CID 59766508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).