2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine

C15H30N4 — CID 79055749

IUPAC2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine
SMILESCCCn1ccnc1C(NC)C(C)(C)N(CC)CC
InChIInChI=1S/C15H30N4/c1-7-11-18-12-10-17-14(18)13(16-6)15(4,5)19(8-2)9-3/h10,12-13,16H,7-9,11H2,1-6H3
InChIKeyZEKZYHQDJKQMCF-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.67
Rot. Bonds8

About 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine

2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine (PubChem CID 79055749) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine
PubChem CID79055749
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC Name2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine
SMILESCCCn1ccnc1C(NC)C(C)(C)N(CC)CC
InChIInChI=1S/C15H30N4/c1-7-11-18-12-10-17-14(18)13(16-6)15(4,5)19(8-2)9-3/h10,12-13,16H,7-9,11H2,1-6H3
InChIKeyZEKZYHQDJKQMCF-UHFFFAOYSA-N
XLogP2.67
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79053769
1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine
CID 79056002
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol
CID 79064029
[2-methoxy-2-methyl-1-(1-propylimidazol-2-yl)propyl]hydrazine
CID 105245368
2-(dimethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79047519
[3,3-dimethyl-1-(1-propylimidazol-2-yl)butyl]hydrazine
CID 105220315
2-ethoxy-N-methyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 64534593
1-(1-ethylcyclopentyl)-N-methyl-1-(1-propylimidazol-2-yl)methanamine
CID 115858981
2-N,2-N-diethyl-3-N,2-dimethyl-5-(1-methylimidazol-2-yl)pentane-2,3-diamine
CID 114530408
[3-methoxy-3-methyl-1-(1-propylimidazol-2-yl)butyl]hydrazine
CID 103025320
N,N-dimethyl-1-[methylamino-(1-propylimidazol-2-yl)methyl]cycloheptan-1-amine
CID 79064561
N-ethyl-2-methyl-2-morpholin-4-yl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 79051327

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine?
The IUPAC name of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine (CID 79055749) is 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine?
The canonical SMILES for 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine is CCCn1ccnc1C(NC)C(C)(C)N(CC)CC.
What is the InChIKey of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine?
The InChIKey is ZEKZYHQDJKQMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-7-11-18-12-10-17-14(18)13(16-6)15(4,5)19(8-2)9-3/h10,12-13,16H,7-9,11H2,1-6H3.
What are the key properties of 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine?
2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine has a molecular weight of 266.43 g/mol, XLogP of 2.67, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine is sourced from PubChem (CID 79055749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).