N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine

C14H30N2 — CID 83994824

IUPACN-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine
SMILESCC(C)C1CC(NCC(C)(C)C)CN(C)C1
InChIInChI=1S/C14H30N2/c1-11(2)12-7-13(9-16(6)8-12)15-10-14(3,4)5/h11-13,15H,7-10H2,1-6H3
InChIKeyYYDZBCLKBLVANK-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.60
Rot. Bonds3

About N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine

N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine (PubChem CID 83994824) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine
PubChem CID83994824
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine
SMILESCC(C)C1CC(NCC(C)(C)C)CN(C)C1
InChIInChI=1S/C14H30N2/c1-11(2)12-7-13(9-16(6)8-12)15-10-14(3,4)5/h11-13,15H,7-10H2,1-6H3
InChIKeyYYDZBCLKBLVANK-UHFFFAOYSA-N
XLogP2.60
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(2,2-dimethylpropylamino)-5-propan-2-ylpiperidin-1-yl]-2,2-dimethylpropan-1-one
CID 83995119
1-[5-(2,2-dimethylpropylamino)-1-propylpiperidin-3-yl]ethanol
CID 83994912
1-[5-(2,2-dimethylpropylamino)-1-methylpiperidin-3-yl]-3,3-dimethylbutan-2-ol
CID 83994848
1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine
CID 131107734
1-[5-(ethylamino)-1-methylpiperidin-3-yl]ethanol
CID 83990165
(3R,5S)-1,3-dimethyl-5-propan-2-ylpiperidine
CID 134236190
1-[3-(2,2-dimethylpropylamino)-5-(1-hydroxyethyl)piperidin-1-yl]ethanone
CID 83995067
5-(2,2-dimethylpropyl)-1-methyl-N-(2,2,2-trifluoroethyl)piperidin-3-amine
CID 83992057
1-(1-cyclobutylethyl)-N-(2,2-dimethylpropyl)-5-methylpiperidin-3-amine
CID 83995335
methyl N-(1-methyl-5-propan-2-ylpiperidin-3-yl)carbamate
CID 112542976
N-(2,2-dimethylpropyl)-3-propan-2-yloxycyclobutan-1-amine
CID 177265362
1-[1-cyclopropyl-5-(2,2-dimethylpropylamino)piperidin-3-yl]propan-1-ol
CID 83995239

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine (CID 83994824) is N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine is CC(C)C1CC(NCC(C)(C)C)CN(C)C1.
What is the InChIKey of N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine?
The InChIKey is YYDZBCLKBLVANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-11(2)12-7-13(9-16(6)8-12)15-10-14(3,4)5/h11-13,15H,7-10H2,1-6H3.
What are the key properties of N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine?
N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine has a molecular weight of 226.41 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-1-methyl-5-propan-2-ylpiperidin-3-amine is sourced from PubChem (CID 83994824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).