N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine

C13H26N2 — CID 103465025

IUPACN-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine
SMILESCCC(C)(C)CN1CCC(NC2CC2)C1
InChIInChI=1S/C13H26N2/c1-4-13(2,3)10-15-8-7-12(9-15)14-11-5-6-11/h11-12,14H,4-10H2,1-3H3
InChIKeyKXHPJHVIEZMOFE-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds5

About N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine

N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine (PubChem CID 103465025) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine
PubChem CID103465025
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine
SMILESCCC(C)(C)CN1CCC(NC2CC2)C1
InChIInChI=1S/C13H26N2/c1-4-13(2,3)10-15-8-7-12(9-15)14-11-5-6-11/h11-12,14H,4-10H2,1-3H3
InChIKeyKXHPJHVIEZMOFE-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-dimethylbutyl)-N-propylpyrrolidin-3-amine
CID 103461871
1-(2,2-dimethylbutyl)-N-propylpiperidin-4-amine
CID 103461877
N-cyclopropyl-1-(2,2,3,3-tetrafluoropropyl)pyrrolidin-3-amine
CID 106294062
(3R,4S)-1-(2,2-dimethylbutyl)-4-fluoropiperidin-3-ol
CID 138498136
N-cyclopropyl-1-(2-methoxy-2-methylpropyl)piperidin-3-amine
CID 104766166
1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine
CID 63452666
1-ethyl-N-(4-propylcyclohexyl)piperidin-4-amine
CID 60663750
tert-butyl 3-[(1-ethylpiperidin-4-yl)amino]pyrrolidine-1-carboxylate
CID 81338126
N-cyclopropyl-1-(2,3,3-trimethylbutyl)piperidin-3-amine
CID 83147276
N-cyclopropyl-1-[(2-methylcyclopentyl)methyl]pyrrolidin-3-amine
CID 107420794
N-ethyl-1-(2,2,2-trifluoroethyl)pyrrolidin-3-amine;dihydrochloride
CID 122156751
N-cyclopropyl-1-[2-(1-methylpyrazol-3-yl)ethyl]pyrrolidin-3-amine
CID 114144133

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine?
The IUPAC name of N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine (CID 103465025) is N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine.
What is the SMILES notation for N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine?
The canonical SMILES for N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine is CCC(C)(C)CN1CCC(NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine?
The InChIKey is KXHPJHVIEZMOFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-13(2,3)10-15-8-7-12(9-15)14-11-5-6-11/h11-12,14H,4-10H2,1-3H3.
What are the key properties of N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine?
N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2,2-dimethylbutyl)pyrrolidin-3-amine is sourced from PubChem (CID 103465025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).