N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine

C13H28N2 — CID 63300198

IUPACN-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine
SMILESCCCN(C1CCNC1)C(CC)C(C)C
InChIInChI=1S/C13H28N2/c1-5-9-15(12-7-8-14-10-12)13(6-2)11(3)4/h11-14H,5-10H2,1-4H3
InChIKeyMAGOENDINKWOCU-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.49
Rot. Bonds6

About N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine

N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine (PubChem CID 63300198) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine
PubChem CID63300198
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine
SMILESCCCN(C1CCNC1)C(CC)C(C)C
InChIInChI=1S/C13H28N2/c1-5-9-15(12-7-8-14-10-12)13(6-2)11(3)4/h11-14H,5-10H2,1-4H3
InChIKeyMAGOENDINKWOCU-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-N-propylpiperidin-4-amine
CID 60806146
N-butan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 63304037
3,4-dimethyl-N-propyl-N-pyrrolidin-3-ylpentanamide
CID 119533162
N-[1-(2-methoxyphenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 63300912
N-[1-(4-chlorophenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 63300570
N-[1-(4-propoxyphenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 63300783
N-butan-2-yl-N-methoxypyrrolidin-3-amine
CID 165348244
N-tert-butyl-2-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 63304566
N-(5-methylheptan-3-yl)-N-propylpiperidin-3-amine
CID 63636390
N-[4-(4-methoxyphenyl)butan-2-yl]-N-propylpyrrolidin-3-amine
CID 63300831
N-(3-methyl-1-phenylbutyl)-N-propylpyrrolidin-3-amine
CID 63300659
3-ethyl-4-methyl-N-propyl-N-pyrrolidin-3-ylpentanamide;hydrochloride
CID 119530049

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine?
The IUPAC name of N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine (CID 63300198) is N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine.
What is the SMILES notation for N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine?
The canonical SMILES for N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine is CCCN(C1CCNC1)C(CC)C(C)C.
What is the InChIKey of N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine?
The InChIKey is MAGOENDINKWOCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-9-15(12-7-8-14-10-12)13(6-2)11(3)4/h11-14H,5-10H2,1-4H3.
What are the key properties of N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine?
N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpentan-3-yl)-N-propylpyrrolidin-3-amine is sourced from PubChem (CID 63300198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).