N,N-dibutylcyclohexa-1,5-dien-1-amine

C14H25N — CID 21441409

IUPACN,N-dibutylcyclohexa-1,5-dien-1-amine
SMILESCCCCN(CCCC)C1=CCCC=C1
InChIInChI=1S/C14H25N/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14/h8,10-11H,3-7,9,12-13H2,1-2H3
InChIKeyLAGHZPUIEOATEV-UHFFFAOYSA-N
MW207.36 g/mol
LogP4.12
Rot. Bonds7

About N,N-dibutylcyclohexa-1,5-dien-1-amine

N,N-dibutylcyclohexa-1,5-dien-1-amine (PubChem CID 21441409) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N,N-dibutylcyclohexa-1,5-dien-1-amine.

Molecular Properties

Compound NameN,N-dibutylcyclohexa-1,5-dien-1-amine
PubChem CID21441409
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN,N-dibutylcyclohexa-1,5-dien-1-amine
SMILESCCCCN(CCCC)C1=CCCC=C1
InChIInChI=1S/C14H25N/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14/h8,10-11H,3-7,9,12-13H2,1-2H3
InChIKeyLAGHZPUIEOATEV-UHFFFAOYSA-N
XLogP4.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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CID 58329250
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CID 67978398
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CID 68311864
n-Butyl-n-methylpyridine
CID 154224413
1-fluoro-N-methyl-N-propylcyclohexa-2,4-dien-1-amine
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Frequently Asked Questions

What is the IUPAC name of N,N-dibutylcyclohexa-1,5-dien-1-amine?
The IUPAC name of N,N-dibutylcyclohexa-1,5-dien-1-amine (CID 21441409) is N,N-dibutylcyclohexa-1,5-dien-1-amine.
What is the SMILES notation for N,N-dibutylcyclohexa-1,5-dien-1-amine?
The canonical SMILES for N,N-dibutylcyclohexa-1,5-dien-1-amine is CCCCN(CCCC)C1=CCCC=C1.
What is the InChIKey of N,N-dibutylcyclohexa-1,5-dien-1-amine?
The InChIKey is LAGHZPUIEOATEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14/h8,10-11H,3-7,9,12-13H2,1-2H3.
What are the key properties of N,N-dibutylcyclohexa-1,5-dien-1-amine?
N,N-dibutylcyclohexa-1,5-dien-1-amine has a molecular weight of 207.36 g/mol, XLogP of 4.12, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutylcyclohexa-1,5-dien-1-amine is sourced from PubChem (CID 21441409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).