2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine

C19H40N2 — CID 114596717

IUPAC2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine
SMILESCCCC(C)(CNCC(C)C)CN1CC(C)CC(C)C1C
InChIInChI=1S/C19H40N2/c1-8-9-19(7,13-20-11-15(2)3)14-21-12-16(4)10-17(5)18(21)6/h15-18,20H,8-14H2,1-7H3
InChIKeyLXTXVDFJZDDHAO-UHFFFAOYSA-N
MW296.54 g/mol
LogP4.40
Rot. Bonds8

About 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine

2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine (PubChem CID 114596717) has the molecular formula C19H40N2 and a molecular weight of 296.54 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine
PubChem CID114596717
Molecular FormulaC19H40N2
Molecular Weight296.54 g/mol
Exact Mass296.32
IUPAC Name2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine
SMILESCCCC(C)(CNCC(C)C)CN1CC(C)CC(C)C1C
InChIInChI=1S/C19H40N2/c1-8-9-19(7,13-20-11-15(2)3)14-21-12-16(4)10-17(5)18(21)6/h15-18,20H,8-14H2,1-7H3
InChIKeyLXTXVDFJZDDHAO-UHFFFAOYSA-N
XLogP4.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.54
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]-2-methyl-N-(2-methylpropyl)pentan-1-amine
CID 104960621
N-tert-butyl-2-methyl-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]butan-1-amine
CID 114596807
2-methyl-N-(2-methylpropyl)-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)pentan-1-amine
CID 66369812
2-methyl-N-(2-methylpropyl)-2-(piperidin-1-ylmethyl)pentan-1-amine
CID 62264125
1-[2-(bromomethyl)-2-propylpentyl]-2,3,5-trimethylpiperidine
CID 114594789
2-methyl-N-(2-methylpropyl)-2-(thiomorpholin-4-ylmethyl)pentan-1-amine
CID 62262511
2-[(3-methoxypyrrolidin-1-yl)methyl]-2-methyl-N-(2-methylpropyl)pentan-1-amine
CID 103539012
2-[(2,3-dimethylpiperidin-1-yl)methyl]-N-ethyl-2-methylpentan-1-amine
CID 62256342
2-[(4-methoxypiperidin-1-yl)methyl]-2-methyl-N-(2-methylpropyl)pentan-1-amine
CID 62264057
2-methyl-N-(2-methylpropyl)-2-propylnonan-1-amine
CID 63509093
2-methyl-1-(2,3,5-trimethylpiperidin-1-yl)butan-2-ol
CID 114594601
3-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-3-amine
CID 114593805

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine?
The IUPAC name of 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine (CID 114596717) is 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine?
The canonical SMILES for 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine is CCCC(C)(CNCC(C)C)CN1CC(C)CC(C)C1C.
What is the InChIKey of 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine?
The InChIKey is LXTXVDFJZDDHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2/c1-8-9-19(7,13-20-11-15(2)3)14-21-12-16(4)10-17(5)18(21)6/h15-18,20H,8-14H2,1-7H3.
What are the key properties of 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine?
2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine has a molecular weight of 296.54 g/mol, XLogP of 4.40, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropyl)-2-[(2,3,5-trimethylpiperidin-1-yl)methyl]pentan-1-amine is sourced from PubChem (CID 114596717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).