5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine

C17H28N2 — CID 115145890

IUPAC5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine
SMILESCc1cc(C)c(C)c(CNC2CNC(C)(C)C2)c1C
InChIInChI=1S/C17H28N2/c1-11-7-12(2)14(4)16(13(11)3)10-18-15-8-17(5,6)19-9-15/h7,15,18-19H,8-10H2,1-6H3
InChIKeySVSJCAZMELLOTP-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.15
Rot. Bonds3

About 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine

5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine (PubChem CID 115145890) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine
PubChem CID115145890
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine
SMILESCc1cc(C)c(C)c(CNC2CNC(C)(C)C2)c1C
InChIInChI=1S/C17H28N2/c1-11-7-12(2)14(4)16(13(11)3)10-18-15-8-17(5,6)19-9-15/h7,15,18-19H,8-10H2,1-6H3
InChIKeySVSJCAZMELLOTP-UHFFFAOYSA-N
XLogP3.15
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-methoxy-3-methylphenyl)methyl]-5,5-dimethylpyrrolidin-3-amine
CID 115145867
2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine
CID 115145488
5,5-dimethyl-N-[[4-(2-methylpropyl)phenyl]methyl]pyrrolidin-3-amine
CID 115145878
N-(2-methoxy-4,5-dimethylphenyl)-5,5-dimethylpyrrolidin-3-amine
CID 115145678
5,5-dimethyl-N-[(1-methylbenzimidazol-5-yl)methyl]pyrrolidin-3-amine
CID 115145923
5,5-dimethyl-N-[(1-methylindol-3-yl)methyl]pyrrolidin-3-amine
CID 115145902
N-(3,4-difluorophenyl)-5,5-dimethylpyrrolidin-3-amine
CID 115145682
3,3-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-amine
CID 114544213
N-(2,3-dihydro-1H-inden-5-yl)-5,5-dimethylpyrrolidin-3-amine
CID 115145666
N-[2-(3-bromo-4-methoxyphenyl)ethyl]-5,5-dimethylpyrrolidin-3-amine
CID 115146036
N-(2,5-difluorophenyl)-5,5-dimethylpyrrolidin-3-amine
CID 115145681
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,5-dimethylpyrrolidin-3-amine
CID 115145670

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine?
The IUPAC name of 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine (CID 115145890) is 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine.
What is the SMILES notation for 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine?
The canonical SMILES for 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine is Cc1cc(C)c(C)c(CNC2CNC(C)(C)C2)c1C.
What is the InChIKey of 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine?
The InChIKey is SVSJCAZMELLOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-11-7-12(2)14(4)16(13(11)3)10-18-15-8-17(5,6)19-9-15/h7,15,18-19H,8-10H2,1-6H3.
What are the key properties of 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine?
5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine has a molecular weight of 260.43 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine is sourced from PubChem (CID 115145890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).