N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine

C15H29N3 — CID 83044065

IUPACN-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine
SMILESCCCc1nccn1C(CCC)CNC(C)(C)C
InChIInChI=1S/C15H29N3/c1-6-8-13(12-17-15(3,4)5)18-11-10-16-14(18)9-7-2/h10-11,13,17H,6-9,12H2,1-5H3
InChIKeyBEUDTVYDQNRNEF-UHFFFAOYSA-N
MW251.42 g/mol
LogP3.56
Rot. Bonds7

About N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine

N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine (PubChem CID 83044065) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine
PubChem CID83044065
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC NameN-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine
SMILESCCCc1nccn1C(CCC)CNC(C)(C)C
InChIInChI=1S/C15H29N3/c1-6-8-13(12-17-15(3,4)5)18-11-10-16-14(18)9-7-2/h10-11,13,17H,6-9,12H2,1-5H3
InChIKeyBEUDTVYDQNRNEF-UHFFFAOYSA-N
XLogP3.56
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-1-heptan-4-ylimidazole
CID 91216339
N-tert-butyl-2-(2-ethylimidazol-1-yl)-3-methylbutan-1-amine
CID 55072805
N-tert-butyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)pentan-1-amine
CID 83045708
N-ethyl-2-(2-methylimidazol-1-yl)pentan-1-amine
CID 83046025
3-amino-2-(2-propylimidazol-1-yl)hexan-1-ol
CID 114357761
1-N-tert-butyl-2-N-methyl-2-N-[(1-methylimidazol-2-yl)methyl]pentane-1,2-diamine
CID 83054407
N-tert-butyl-2-cyclopentyl-4-(1-methylimidazol-2-yl)butan-1-amine
CID 114531599
N-tert-butyl-2-(4-chloro-3-methylpyrazol-1-yl)pentan-1-amine
CID 83044250
1-(tert-butylamino)-3-(2-ethylimidazol-1-yl)propan-2-ol
CID 115475677
2-methyl-2-(propan-2-ylamino)-4-(2-propylimidazol-1-yl)pentanoic acid
CID 64707106
N-tert-butyl-3-methyl-2-(2-propan-2-ylimidazol-1-yl)butan-1-amine
CID 55138699
2-(benzotriazol-1-yl)-N-tert-butylpentan-1-amine
CID 83044953

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine?
The IUPAC name of N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine (CID 83044065) is N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine.
What is the SMILES notation for N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine?
The canonical SMILES for N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine is CCCc1nccn1C(CCC)CNC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine?
The InChIKey is BEUDTVYDQNRNEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-6-8-13(12-17-15(3,4)5)18-11-10-16-14(18)9-7-2/h10-11,13,17H,6-9,12H2,1-5H3.
What are the key properties of N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine?
N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine has a molecular weight of 251.42 g/mol, XLogP of 3.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2-propylimidazol-1-yl)pentan-1-amine is sourced from PubChem (CID 83044065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).