N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine

C13H26N2 — CID 115727975

IUPACN-but-3-en-2-yl-1-tert-butylpiperidin-4-amine
SMILESC=CC(C)NC1CCN(C(C)(C)C)CC1
InChIInChI=1S/C13H26N2/c1-6-11(2)14-12-7-9-15(10-8-12)13(3,4)5/h6,11-12,14H,1,7-10H2,2-5H3
InChIKeyFSINDBKNDCJSTL-UHFFFAOYSA-N
MW210.37 g/mol
LogP2.41
Rot. Bonds3

About N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine

N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine (PubChem CID 115727975) has the molecular formula C13H26N2 and a molecular weight of 210.37 g/mol. Its IUPAC name is N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine.

Molecular Properties

Compound NameN-but-3-en-2-yl-1-tert-butylpiperidin-4-amine
PubChem CID115727975
Molecular FormulaC13H26N2
Molecular Weight210.37 g/mol
Exact Mass210.21
IUPAC NameN-but-3-en-2-yl-1-tert-butylpiperidin-4-amine
SMILESC=CC(C)NC1CCN(C(C)(C)C)CC1
InChIInChI=1S/C13H26N2/c1-6-11(2)14-12-7-9-15(10-8-12)13(3,4)5/h6,11-12,14H,1,7-10H2,2-5H3
InChIKeyFSINDBKNDCJSTL-UHFFFAOYSA-N
XLogP2.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-but-3-en-2-ylcyclopentanamine
CID 115727919
1-tert-butyl-N-(1,1-difluoropropan-2-yl)piperidin-4-amine
CID 102869208
N-but-3-en-2-yl-1-cyclopropylpyrrolidin-3-amine
CID 115727974
N-but-3-en-2-yl-4-ethylcyclohexan-1-amine
CID 115727829
(1-tert-butylpiperidin-4-yl)hydrazine
CID 21097250
1-tert-butyl-N-[1-(4-chlorophenyl)ethyl]piperidin-4-amine
CID 60931192
(2R)-1-[(1-tert-butylpiperidin-4-yl)amino]propan-2-ol
CID 103906834
2-[(1-tert-butylpiperidin-4-yl)amino]butanoic acid
CID 115353170
1-tert-butyl-N-cyclooctylpiperidin-4-amine
CID 54866557
N-but-3-en-2-yl-3,5-dimethylcyclohexan-1-amine
CID 115755990
1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine
CID 106757617
N-(1-tert-butylpiperidin-4-yl)-1-(1-methylsulfanylethyl)piperidin-4-amine
CID 146526516

Frequently Asked Questions

What is the IUPAC name of N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine?
The IUPAC name of N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine (CID 115727975) is N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine.
What is the SMILES notation for N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine?
The canonical SMILES for N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine is C=CC(C)NC1CCN(C(C)(C)C)CC1.
What is the InChIKey of N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine?
The InChIKey is FSINDBKNDCJSTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-6-11(2)14-12-7-9-15(10-8-12)13(3,4)5/h6,11-12,14H,1,7-10H2,2-5H3.
What are the key properties of N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine?
N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine has a molecular weight of 210.37 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-3-en-2-yl-1-tert-butylpiperidin-4-amine is sourced from PubChem (CID 115727975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).