N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine

C15H28N4 — CID 106568401

IUPACN-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
SMILESCCCCNc1nccn1C1CCN(CCC)CC1
InChIInChI=1S/C15H28N4/c1-3-5-8-16-15-17-9-13-19(15)14-6-11-18(10-4-2)12-7-14/h9,13-14H,3-8,10-12H2,1-2H3,(H,16,17)
InChIKeyONAZVJOQECLKQF-UHFFFAOYSA-N
MW264.42 g/mol
LogP3.14
Rot. Bonds7

About N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine

N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine (PubChem CID 106568401) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
PubChem CID106568401
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC NameN-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
SMILESCCCCNc1nccn1C1CCN(CCC)CC1
InChIInChI=1S/C15H28N4/c1-3-5-8-16-15-17-9-13-19(15)14-6-11-18(10-4-2)12-7-14/h9,13-14H,3-8,10-12H2,1-2H3,(H,16,17)
InChIKeyONAZVJOQECLKQF-UHFFFAOYSA-N
XLogP3.14
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-methyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine
CID 106568397
N-butyl-1-cyclobutylimidazol-2-amine
CID 106571396
1-cyclopropyl-N-propylimidazol-2-amine
CID 106554744
N-butyl-1-(3-methylcyclobutyl)imidazol-2-amine
CID 106581425
N-butyl-1-(3-methylcyclohexyl)imidazol-2-amine
CID 106561726
1-(1-propylpiperidin-4-yl)imidazol-2-amine
CID 106568395
1-cyclopentyl-N-(2-piperidin-1-ylethyl)imidazol-2-amine
CID 106565073
N-butyl-1-(2-methylcyclohexyl)imidazol-2-amine
CID 106558945
N-butyl-1-(2-methylcyclopentyl)imidazol-2-amine
CID 106572877
N-(3-ethoxypropyl)-1-(1-methylpyrrolidin-3-yl)imidazol-2-amine
CID 106566544
N-propyl-1-(thian-4-yl)imidazol-2-amine
CID 106582155
N-(2-methoxyethyl)-1-(1-methylpiperidin-4-yl)imidazol-2-amine
CID 106561605

Frequently Asked Questions

What is the IUPAC name of N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
The IUPAC name of N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine (CID 106568401) is N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine.
What is the SMILES notation for N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
The canonical SMILES for N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine is CCCCNc1nccn1C1CCN(CCC)CC1.
What is the InChIKey of N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
The InChIKey is ONAZVJOQECLKQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-3-5-8-16-15-17-9-13-19(15)14-6-11-18(10-4-2)12-7-14/h9,13-14H,3-8,10-12H2,1-2H3,(H,16,17).
What are the key properties of N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine?
N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine has a molecular weight of 264.42 g/mol, XLogP of 3.14, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-1-(1-propylpiperidin-4-yl)imidazol-2-amine is sourced from PubChem (CID 106568401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).