N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine

C19H39N3 — CID 20709309

IUPACN-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(C)C(C)(C)C1(C)CCN(C2CCN(C)CC2)CC1
InChIInChI=1S/C19H39N3/c1-16(2)21(7)18(3,4)19(5)10-14-22(15-11-19)17-8-12-20(6)13-9-17/h16-17H,8-15H2,1-7H3
InChIKeyGHAYGFSHFRCKFJ-UHFFFAOYSA-N
MW309.54 g/mol
LogP3.30
Rot. Bonds4

About N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine

N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine (PubChem CID 20709309) has the molecular formula C19H39N3 and a molecular weight of 309.54 g/mol. Its IUPAC name is N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine
PubChem CID20709309
Molecular FormulaC19H39N3
Molecular Weight309.54 g/mol
Exact Mass309.31
IUPAC NameN-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(C)C(C)(C)C1(C)CCN(C2CCN(C)CC2)CC1
InChIInChI=1S/C19H39N3/c1-16(2)21(7)18(3,4)19(5)10-14-22(15-11-19)17-8-12-20(6)13-9-17/h16-17H,8-15H2,1-7H3
InChIKeyGHAYGFSHFRCKFJ-UHFFFAOYSA-N
XLogP3.30
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.54
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine (CID 20709309) is N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine is CC(C)N(C)C(C)(C)C1(C)CCN(C2CCN(C)CC2)CC1.
What is the InChIKey of N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine?
The InChIKey is GHAYGFSHFRCKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N3/c1-16(2)21(7)18(3,4)19(5)10-14-22(15-11-19)17-8-12-20(6)13-9-17/h16-17H,8-15H2,1-7H3.
What are the key properties of N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine?
N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine has a molecular weight of 309.54 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-methyl-1-(1-methylpiperidin-4-yl)piperidin-4-yl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 20709309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).