N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine

C15H32N2 — CID 62413689

IUPACN-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine
SMILESCC1CCCN(C(C)CCNC(C)(C)C)C1C
InChIInChI=1S/C15H32N2/c1-12-8-7-11-17(14(12)3)13(2)9-10-16-15(4,5)6/h12-14,16H,7-11H2,1-6H3
InChIKeyBXWSNNMOFRLICM-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.27
Rot. Bonds4

About N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine

N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine (PubChem CID 62413689) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine
PubChem CID62413689
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine
SMILESCC1CCCN(C(C)CCNC(C)(C)C)C1C
InChIInChI=1S/C15H32N2/c1-12-8-7-11-17(14(12)3)13(2)9-10-16-15(4,5)6/h12-14,16H,7-11H2,1-6H3
InChIKeyBXWSNNMOFRLICM-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-N-tert-butylbutan-1-amine
CID 65322192
N-tert-butyl-3-(3-methylpiperidin-1-yl)butan-1-amine
CID 62437982
N-tert-butyl-3-(2-ethylazepan-1-yl)butan-1-amine
CID 104692382
4-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-tert-butylpentan-1-amine
CID 102728546
4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine
CID 64707838
4-(2,3-dimethylpiperidin-1-yl)-N-ethylpentan-2-amine
CID 64707637
N-tert-butyl-3-(3,4,5-trimethylpiperazin-1-yl)butan-1-amine
CID 114540096
N-tert-butyl-4-(2-propylpiperidin-1-yl)pentan-1-amine
CID 83061621
N-tert-butyl-3-(4-propylpiperidin-1-yl)butan-1-amine
CID 55069814
N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butan-1-amine
CID 62462303
N-tert-butyl-3-methyl-2-(2-methylpyrrolidin-1-yl)butan-1-amine
CID 62439520
2-(2,3-dimethylpiperidin-1-yl)-N-ethylbutan-1-amine
CID 62413504

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine?
The IUPAC name of N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine (CID 62413689) is N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine.
What is the SMILES notation for N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine?
The canonical SMILES for N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine is CC1CCCN(C(C)CCNC(C)(C)C)C1C.
What is the InChIKey of N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine?
The InChIKey is BXWSNNMOFRLICM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-12-8-7-11-17(14(12)3)13(2)9-10-16-15(4,5)6/h12-14,16H,7-11H2,1-6H3.
What are the key properties of N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine?
N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine has a molecular weight of 240.43 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine is sourced from PubChem (CID 62413689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).