N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine

C11H21N3 — CID 114998586

IUPACN-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine
SMILESCCCc1cnc(CCNC(C)C)[nH]1
InChIInChI=1S/C11H21N3/c1-4-5-10-8-13-11(14-10)6-7-12-9(2)3/h8-9,12H,4-7H2,1-3H3,(H,13,14)
InChIKeyATAMODBLIVDEJQ-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.90
Rot. Bonds6

About N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine

N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine (PubChem CID 114998586) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine
PubChem CID114998586
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine
SMILESCCCc1cnc(CCNC(C)C)[nH]1
InChIInChI=1S/C11H21N3/c1-4-5-10-8-13-11(14-10)6-7-12-9(2)3/h8-9,12H,4-7H2,1-3H3,(H,13,14)
InChIKeyATAMODBLIVDEJQ-UHFFFAOYSA-N
XLogP1.90
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-butyl-5-propyl-1H-imidazole
CID 68810469
N-[(2-propyl-1H-imidazol-5-yl)methyl]propan-1-amine
CID 63108587
N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
CID 63108982
N-[2-[5-(4-methylphenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60852379
N-[2-(5-phenyl-1H-imidazol-2-yl)ethyl]propan-2-amine
CID 60852746
3-(5-methyl-1H-imidazol-2-yl)-N-propan-2-ylpropan-1-amine
CID 114995817
N-[2-[5-(2,4-difluorophenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60854362
2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine
CID 63109492
N-[2-[5-(3-methylthiophen-2-yl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 63990888
N-[2-[5-[4-(2-methylpropyl)phenyl]-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60852192
N-[2-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60853832
2-methyl-5-propyl-1H-imidazole
CID 22956170

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine (CID 114998586) is N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine is CCCc1cnc(CCNC(C)C)[nH]1.
What is the InChIKey of N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
The InChIKey is ATAMODBLIVDEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-4-5-10-8-13-11(14-10)6-7-12-9(2)3/h8-9,12H,4-7H2,1-3H3,(H,13,14).
What are the key properties of N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine?
N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine has a molecular weight of 195.31 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine is sourced from PubChem (CID 114998586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).