N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine

C17H29N3 — CID 102539941

IUPACN,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine
SMILESCCN(CC)c1ncccc1C1CCCN1CC(C)C
InChIInChI=1S/C17H29N3/c1-5-19(6-2)17-15(9-7-11-18-17)16-10-8-12-20(16)13-14(3)4/h7,9,11,14,16H,5-6,8,10,12-13H2,1-4H3
InChIKeyOEWXVBAERRMTRZ-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.72
Rot. Bonds6

About N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine

N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine (PubChem CID 102539941) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine.

Molecular Properties

Compound NameN,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine
PubChem CID102539941
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine
SMILESCCN(CC)c1ncccc1C1CCCN1CC(C)C
InChIInChI=1S/C17H29N3/c1-5-19(6-2)17-15(9-7-11-18-17)16-10-8-12-20(16)13-14(3)4/h7,9,11,14,16H,5-6,8,10,12-13H2,1-4H3
InChIKeyOEWXVBAERRMTRZ-UHFFFAOYSA-N
XLogP3.72
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine?
The IUPAC name of N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine (CID 102539941) is N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine.
What is the SMILES notation for N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine?
The canonical SMILES for N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine is CCN(CC)c1ncccc1C1CCCN1CC(C)C.
What is the InChIKey of N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine?
The InChIKey is OEWXVBAERRMTRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-5-19(6-2)17-15(9-7-11-18-17)16-10-8-12-20(16)13-14(3)4/h7,9,11,14,16H,5-6,8,10,12-13H2,1-4H3.
What are the key properties of N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine?
N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine has a molecular weight of 275.44 g/mol, XLogP of 3.72, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[1-(2-methylpropyl)pyrrolidin-2-yl]pyridin-2-amine is sourced from PubChem (CID 102539941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).