N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine

C14H25N3 — CID 61214993

IUPACN-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
SMILESCn1ccnc1CCNC1CCCCCCC1
InChIInChI=1S/C14H25N3/c1-17-12-11-16-14(17)9-10-15-13-7-5-3-2-4-6-8-13/h11-13,15H,2-10H2,1H3
InChIKeyUFTSPBPKXXPUBX-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.67
Rot. Bonds4

About N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine

N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine (PubChem CID 61214993) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine.

Molecular Properties

Compound NameN-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
PubChem CID61214993
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
SMILESCn1ccnc1CCNC1CCCCCCC1
InChIInChI=1S/C14H25N3/c1-17-12-11-16-14(17)9-10-15-13-7-5-3-2-4-6-8-13/h11-13,15H,2-10H2,1H3
InChIKeyUFTSPBPKXXPUBX-UHFFFAOYSA-N
XLogP2.67
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
CID 61214727
2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-amine
CID 61214730
3-chloro-N-[2-(1-methylimidazol-2-yl)ethyl]cyclobutan-1-amine
CID 114531771
N-[2-(1-methylimidazol-2-yl)ethyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 61215283
N-[2-(1-methylimidazol-2-yl)ethyl]-1,1-dioxothian-3-amine
CID 63923427
3-ethyl-N-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 64501340
N-[2-(1-methylimidazol-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 61210136
1,2-dimethyl-N-[2-(1-methylimidazol-2-yl)ethyl]piperidin-4-amine
CID 81344994
N-[(1-methylimidazol-2-yl)methyl]cyclobutanamine
CID 62415731
N-[3-methyl-5-(1-methylimidazol-2-yl)pentyl]cyclopropanamine
CID 114532982
1-cyclopentyl-3-[2-(1-methylimidazol-2-yl)ethyl]thiourea
CID 116508143
N-[2-(1-methylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 61211277

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine?
The IUPAC name of N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine (CID 61214993) is N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine.
What is the SMILES notation for N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine?
The canonical SMILES for N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine is Cn1ccnc1CCNC1CCCCCCC1.
What is the InChIKey of N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine?
The InChIKey is UFTSPBPKXXPUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-17-12-11-16-14(17)9-10-15-13-7-5-3-2-4-6-8-13/h11-13,15H,2-10H2,1H3.
What are the key properties of N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine?
N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine has a molecular weight of 235.37 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine is sourced from PubChem (CID 61214993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).