N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine

C17H35N3 — CID 129309163

IUPACN,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine
SMILESCC(C)N1CCCC(CC(C)N2CCC(N(C)C)C2)C1
InChIInChI=1S/C17H35N3/c1-14(2)19-9-6-7-16(12-19)11-15(3)20-10-8-17(13-20)18(4)5/h14-17H,6-13H2,1-5H3
InChIKeyKXYVHQFNHFSDBS-UHFFFAOYSA-N
MW281.49 g/mol
LogP2.52
Rot. Bonds5

About N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine

N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine (PubChem CID 129309163) has the molecular formula C17H35N3 and a molecular weight of 281.49 g/mol. Its IUPAC name is N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine
PubChem CID129309163
Molecular FormulaC17H35N3
Molecular Weight281.49 g/mol
Exact Mass281.28
IUPAC NameN,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine
SMILESCC(C)N1CCCC(CC(C)N2CCC(N(C)C)C2)C1
InChIInChI=1S/C17H35N3/c1-14(2)19-9-6-7-16(12-19)11-15(3)20-10-8-17(13-20)18(4)5/h14-17H,6-13H2,1-5H3
InChIKeyKXYVHQFNHFSDBS-UHFFFAOYSA-N
XLogP2.52
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.49
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine?
The IUPAC name of N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine (CID 129309163) is N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine is CC(C)N1CCCC(CC(C)N2CCC(N(C)C)C2)C1.
What is the InChIKey of N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine?
The InChIKey is KXYVHQFNHFSDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3/c1-14(2)19-9-6-7-16(12-19)11-15(3)20-10-8-17(13-20)18(4)5/h14-17H,6-13H2,1-5H3.
What are the key properties of N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine?
N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine has a molecular weight of 281.49 g/mol, XLogP of 2.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[1-(1-propan-2-ylpiperidin-3-yl)propan-2-yl]pyrrolidin-3-amine is sourced from PubChem (CID 129309163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).