2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide

C11H18N4O — CID 66131418

IUPAC2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide
SMILESCCCn1cncc1C(NC1CC1)C(N)=O
InChIInChI=1S/C11H18N4O/c1-2-5-15-7-13-6-9(15)10(11(12)16)14-8-3-4-8/h6-8,10,14H,2-5H2,1H3,(H2,12,16)
InChIKeyCMQHSJVLMQHGFX-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.57
Rot. Bonds6

About 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide

2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide (PubChem CID 66131418) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide
PubChem CID66131418
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide
SMILESCCCn1cncc1C(NC1CC1)C(N)=O
InChIInChI=1S/C11H18N4O/c1-2-5-15-7-13-6-9(15)10(11(12)16)14-8-3-4-8/h6-8,10,14H,2-5H2,1H3,(H2,12,16)
InChIKeyCMQHSJVLMQHGFX-UHFFFAOYSA-N
XLogP0.57
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-(3-propylimidazol-4-yl)ethane-1,2-diamine
CID 66130610
2-(4-chloroanilino)-2-(3-propylimidazol-4-yl)acetamide
CID 66130816
2-(cyclopropylmethylamino)-2-(3-ethylimidazol-4-yl)acetamide
CID 66134304
2-(2-bromoanilino)-2-(3-propylimidazol-4-yl)acetamide
CID 66130419
2-(2-methylpropylamino)-2-(3-propylimidazol-4-yl)acetic acid
CID 66130024
2-chloro-N-cyclohexyl-2-(3-propylimidazol-4-yl)acetamide
CID 66129560
methyl 2-(butan-2-ylamino)-2-(3-propylimidazol-4-yl)acetate
CID 66131426
ethyl 2-anilino-2-(3-propylimidazol-4-yl)acetate
CID 66130621
2-(cyclopropylmethylamino)-2-(3-methylimidazol-4-yl)acetamide
CID 66117112
2-(diethylamino)-2-(3-propylimidazol-4-yl)acetic acid
CID 66130451
2-cyclopentyl-1-(3-propylimidazol-4-yl)ethanol
CID 66129443
N-(3,3-dimethylcyclopentyl)-1-(3-propylimidazol-4-yl)ethane-1,2-diamine
CID 114545027

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide?
The IUPAC name of 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide (CID 66131418) is 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide?
The canonical SMILES for 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide is CCCn1cncc1C(NC1CC1)C(N)=O.
What is the InChIKey of 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide?
The InChIKey is CMQHSJVLMQHGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-5-15-7-13-6-9(15)10(11(12)16)14-8-3-4-8/h6-8,10,14H,2-5H2,1H3,(H2,12,16).
What are the key properties of 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide?
2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide has a molecular weight of 222.29 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-(3-propylimidazol-4-yl)acetamide is sourced from PubChem (CID 66131418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).