N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine

C17H33N3 — CID 106622307

IUPACN-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
SMILESCC(C)N(CC1CCCCN1)C1CCN2CCCC2C1
InChIInChI=1S/C17H33N3/c1-14(2)20(13-15-6-3-4-9-18-15)17-8-11-19-10-5-7-16(19)12-17/h14-18H,3-13H2,1-2H3
InChIKeyQSFJICJKQICGHL-UHFFFAOYSA-N
MW279.47 g/mol
LogP2.47
Rot. Bonds4

About N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine

N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine (PubChem CID 106622307) has the molecular formula C17H33N3 and a molecular weight of 279.47 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
PubChem CID106622307
Molecular FormulaC17H33N3
Molecular Weight279.47 g/mol
Exact Mass279.27
IUPAC NameN-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
SMILESCC(C)N(CC1CCCCN1)C1CCN2CCCC2C1
InChIInChI=1S/C17H33N3/c1-14(2)20(13-15-6-3-4-9-18-15)17-8-11-19-10-5-7-16(19)12-17/h14-18H,3-13H2,1-2H3
InChIKeyQSFJICJKQICGHL-UHFFFAOYSA-N
XLogP2.47
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.47
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine with MolForge

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Related Compounds

8-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 106621974
1-ethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpiperidin-4-amine
CID 106622124
N-(piperidin-2-ylmethyl)-N-propan-2-yloxetan-3-amine
CID 176601027
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 106606366
4,4-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622300
N,3-di(propan-2-yl)-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 107449580
N-(piperidin-2-ylmethyl)-N-propan-2-yloxolan-3-amine
CID 106622294
3,3,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622016
1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine
CID 106603013
2,2-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yloxan-4-amine
CID 106622299
N-pentan-2-yl-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621821
N-(2,6-dimethylheptan-4-yl)-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621648

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine (CID 106622307) is N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine is CC(C)N(CC1CCCCN1)C1CCN2CCCC2C1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
The InChIKey is QSFJICJKQICGHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3/c1-14(2)20(13-15-6-3-4-9-18-15)17-8-11-19-10-5-7-16(19)12-17/h14-18H,3-13H2,1-2H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine has a molecular weight of 279.47 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine is sourced from PubChem (CID 106622307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).